Chembase list of 866358 unique molecular structures

$$$$ Data More

M. F.

C6H3BrN2

Suppliers	Catalog Number
Sigma Aldrich	574422
Alfa Aesar	B24835
Matrix Scientific	020584

Database	Data ID
PubChem	736793

M. W.

183.00542

CAS

35590-37-5

Similarity

N/A

ID: 18452

6-bromopyridine-2-carbaldehyde

$$$$ Data More

M. F.

C6H4BrNO

Suppliers	Catalog Number
Sigma Aldrich	525693
Alfa Aesar	L19518
Matrix Scientific	020585

Database	Data ID
PubChem	2757009

M. W.

186.00606

CAS

34160-40-2

Similarity

N/A

ID: 18453

5-bromo-3-nitropyridin-2-ol

$$$$ Data More

M. F.

C5H3BrN2O3

Suppliers	Catalog Number
Sigma Aldrich	658448
Alfa Aesar	L19850
Matrix Scientific	020586

Database	Data ID
PubChem	85147

M. W.

218.99292

CAS

15862-34-7

Similarity

N/A

ID: 18454

6-methoxypyridine-3-carbonitrile

$$$$ Data More

M. F.

C7H6N2O

Suppliers	Catalog Number
Sigma Aldrich	642258
Matrix Scientific	020587
Maybridge	SPB04785

Database	Data ID
PubChem	2736776

M. W.

134.13534

CAS

15871-85-9

Similarity

N/A

ID: 18455

2-chloro-4-methylpyrimidine

$$$$ Data More

M. F.

C5H5ClN2

Suppliers	Catalog Number
Alfa Aesar	H31903
Matrix Scientific	020588
Key Organics	FA-0251

Database	Data ID
PubChem	11629607

M. W.

128.5596

CAS

13036-57-2

Similarity

N/A

ID: 18456

thiophene-2,5-dicarboxylic acid

$$$$ Data More

M. F.

C6H4O4S

Suppliers	Catalog Number
Sigma Aldrich	405191
Alfa Aesar	L10293
Matrix Scientific	020591

Database	Data ID
PubChem	20273

M. W.

172.15856

CAS

4282-31-9

Similarity

N/A

ID: 18457

2-fluoroethan-1-amine hydrochloride

$$$$ Data More

M. F.

C2H7ClFN

Suppliers	Catalog Number
Sigma Aldrich	429058
Matrix Scientific	020592
Apollo Scientific	PC3677

Database	Data ID
PubChem	9995

M. W.

99.5350832

CAS

460-08-2

Similarity

N/A

ID: 18458

4-bromo-2-methylpyridine

$$$$ Data More

M. F.

C6H6BrN

Suppliers	Catalog Number
Sigma Aldrich	662739
ChemBridge	4014101
Alfa Aesar	H27884

Database	Data ID
PubChem	2762835

M. W.

172.02254

CAS

22282-99-1

Similarity

N/A

ID: 18459

ethyl 5-methyl-1H-pyrrole-2-carboxylate

$$$$ Data

M. F.

C8H11NO2

Suppliers	Catalog Number
Matrix Scientific	020594
Bide Pharmatech	BD104665
A&J Pharmtech	AJA-O10058

Database	Data ID
PubChem	96598

M. W.

153.17844

CAS

3284-51-3

Similarity

N/A

ID: 18460

(2-methylpyridin-4-yl)boronic acid

$$$$ Data More

M. F.

C6H8BNO2

Suppliers	Catalog Number
Matrix Scientific	020595
Apollo Scientific	OR2618
Bide Pharmatech	BD29130

Database	Data ID
PubChem	4192664

M. W.

136.94422

CAS

579476-63-4

Similarity

N/A

ID: 18461

6-bromo-5-isocyanopyridine-2,4-diamine

$$$$ Data

M. F.

C6H5BrN4

Suppliers	Catalog Number
Matrix Scientific	020596

Database	Data ID
PubChem	23383696

M. W.

213.0347

CAS

Similarity

N/A

ID: 18462

5-isocyanopyridine-2,4-diamine

$$$$ Data

M. F.

C6H6N4

Suppliers	Catalog Number
Matrix Scientific	020597

Database	Data ID
PubChem	23383693

M. W.

134.13864

CAS

Similarity

N/A

ID: 18463

4-fluoro-1-iodo-2-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H3F4I

Suppliers	Catalog Number
Matrix Scientific	020598
Apollo Scientific	PC9107

Database	Data ID
PubChem	44630781

M. W.

289.9968028

CAS

Similarity

N/A

ID: 18464

2-ethoxy-6-fluorobenzonitrile

$$$$ Data

M. F.

C9H8FNO

Suppliers	Catalog Number
Matrix Scientific	020599
Apollo Scientific	PC8608
Bide Pharmatech	BD74475

Database	Data ID
PubChem	7018320

M. W.

165.1643232

CAS

119584-73-5

Similarity

N/A

ID: 18465

2-fluoro-4-methoxybenzoyl chloride

$$$$ Data More

M. F.

C8H6ClFO2

Suppliers	Catalog Number
Alfa Aesar	H31644
Matrix Scientific	020600
Apollo Scientific	PC9192

Database	Data ID
PubChem	14484714

M. W.

188.5834432

CAS

394-42-3

Similarity

N/A

ID: 18466

3-amino-5-fluorobenzonitrile

$$$$ Data More

M. F.

C7H5FN2

Suppliers	Catalog Number
Matrix Scientific	020601
Apollo Scientific	PC7168
Chemik	CHB27871

Database	Data ID
PubChem	2756432

M. W.

136.1264032

CAS

210992-28-2

Similarity

N/A

ID: 18467

4-bromo-2-chlorobenzonitrile

$$$$ Data More

M. F.

C7H3BrClN

Suppliers	Catalog Number
Alfa Aesar	L10602
Matrix Scientific	020603
Apollo Scientific	OR48257

Database	Data ID
PubChem	7010420

M. W.

216.46242

CAS

154607-01-9

Similarity

N/A

ID: 18468

3-bromopyridin-2-amine

$$$$ Data More

M. F.

C5H5BrN2

Suppliers	Catalog Number
Sigma Aldrich	553719
Alfa Aesar	L20006
Matrix Scientific	020605

Database	Data ID
PubChem	817700

M. W.

173.0106

CAS

13534-99-1

Similarity

N/A

ID: 18469

2-chloro-5-(chloromethyl)pyridine

$$$$ Data More

M. F.

C6H5Cl2N

Suppliers	Catalog Number
Sigma Aldrich	516910
Alfa Aesar	L19284
Matrix Scientific	020606

Database	Data ID
PubChem	155479

M. W.

162.0166

CAS

70258-18-3

Similarity

N/A

ID: 18470

1-(2-hydroxyethyl)imidazolidine-2-thione

$$$$ Data More

M. F.

C5H10N2OS

Suppliers	Catalog Number
Matrix Scientific	020607
Apollo Scientific	OR30400
TRC	H942205

Database	Data ID
PubChem	2801741

M. W.

146.2107

CAS

932-49-0

Similarity

N/A

ID: 18471

5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-one

$$$$ Data More

M. F.

C10H10O2

Suppliers	Catalog Number
Sigma Aldrich	219975
Alfa Aesar	A17034
Matrix Scientific	020608

Database	Data ID
PubChem	119921

M. W.

162.1852

CAS

28315-93-7

Similarity

N/A

ID: 18472

2-methyl-6-nitroaniline

$$$$ Data More

M. F.

C7H8N2O2

Suppliers	Catalog Number
Sigma Aldrich	M59408 68007 45953
MP Biomedicals	05203585
Matrix Scientific	020609

Database	Data ID
PubChem	11298

M. W.

152.15062

CAS

570-24-1

Similarity

N/A

ID: 18473

2,3,4,5-tetrachloro-6-(trichloromethyl)pyridine

$$$$ Data More

M. F.

C6Cl7N

Suppliers	Catalog Number
Matrix Scientific	020610
Enamine	EN300-16704
Bide Pharmatech	BD64830

Database	Data ID
PubChem	70811

M. W.

334.2419

CAS

1134-04-9

Similarity

N/A

ID: 18474

[1-(trifluoromethyl)cyclopropyl]benzene

$$$$ Data

M. F.

C10H9F3

Suppliers	Catalog Number
Alfa Aesar	H26056
Matrix Scientific	020611
Apollo Scientific	PC4274

Database	Data ID
PubChem	20405523

M. W.

186.1736696

CAS

883547-73-7

Similarity

N/A

ID: 18475

4-chloro-2,5-dimethylaniline

$$$$ Data More

M. F.

C8H10ClN

Suppliers	Catalog Number
Alfa Aesar	H26018
Matrix Scientific	020612
Maybridge	MAY00162

Database	Data ID
PubChem	12338307

M. W.

155.6247

CAS

20782-94-9

Similarity

N/A

ID: 18476

6-bromopyridine-2-carbonitrile

$$$$ Data More

M. F.

C6H3BrN2

Suppliers	Catalog Number
Sigma Aldrich	684902
Matrix Scientific	020613
Apollo Scientific	OR2804

Database	Data ID
PubChem	15100859

M. W.

183.00542

CAS

122918-25-6

Similarity

N/A

ID: 18477

3-bromo-2-methylpyridine

$$$$ Data More

M. F.

C6H6BrN

Suppliers	Catalog Number
Sigma Aldrich	662720
Alfa Aesar	H27271
Matrix Scientific	020614

Database	Data ID
PubChem	1201003

M. W.

172.02254

CAS

38749-79-0

Similarity

N/A

ID: 18478

2-amino-3-nitrobenzoic acid

$$$$ Data More

M. F.

C7H6N2O4

Suppliers	Catalog Number
Sigma Aldrich	663476
Alfa Aesar	H26001
Matrix Scientific	020615

Database	Data ID
PubChem	219633

M. W.

182.13354

CAS

606-18-8

Similarity

N/A

ID: 18479

4-(4-fluorophenyl)butanoic acid

$$$$ Data More

M. F.

C10H11FO2

Suppliers	Catalog Number
Alfa Aesar	H26035
Matrix Scientific	020616
Apollo Scientific	PC0715

Database	Data ID
PubChem	68524

M. W.

182.1915432

CAS

589-06-0

Similarity

N/A

ID: 18480

2-amino-6,6-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-one

$$$$ Data

M. F.

C9H12N2OS

Suppliers	Catalog Number
Matrix Scientific	020617

Database	Data ID
PubChem	3093508

M. W.

196.26938

CAS

Similarity

N/A

ID: 18481

5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

$$$$ Data

M. F.

C12H6F3N3O2S

Suppliers	Catalog Number
Matrix Scientific	020618

Database	Data ID
PubChem	755339

M. W.

313.2551496

CAS

Similarity

N/A

ID: 18482

4-(5-ethylthiophen-2-yl)-5-methyl-1,3-thiazol-2-amine

$$$$ Data

M. F.

C10H12N2S2

Suppliers	Catalog Number
Matrix Scientific	020620

Database	Data ID
PubChem	6483721

M. W.

224.34568

CAS

Similarity

N/A

ID: 18483

1,3,5-trimethyl-3,7-diazabicyclo[3.3.1]nonane

$$$$ Data

M. F.

C10H20N2

Suppliers	Catalog Number
ChemBridge	4025342
Matrix Scientific	020621
InterBioScreen	BB_SC-4502

Database	Data ID
PubChem	2868122

M. W.

168.2792

CAS

169177-35-9

Similarity

N/A

ID: 18484

3-acetamidobenzene-1-sulfonyl chloride

$$$$ Data More

M. F.

C8H8ClNO3S

Suppliers	Catalog Number
ChemBridge	4001989
Matrix Scientific	020622
Enamine	EN300-43513

Database	Data ID
PubChem	3157455

M. W.

233.67202

CAS

23905-46-6

Similarity

N/A

ID: 18485

2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl chloride

$$$$ Data

M. F.

C9H8ClNO4S

Suppliers	Catalog Number
Matrix Scientific	020623

Database	Data ID
PubChem	6486645

M. W.

261.68212

CAS

Similarity

N/A

ID: 18486

1-{bicyclo[2.2.1]heptan-2-yl}ethan-1-amine

$$$$ Data

M. F.

C9H17N

Suppliers	Catalog Number
ChemBridge	3014688
Matrix Scientific	020625

Database	Data ID
PubChem	161455

M. W.

139.23798

CAS

24520-60-3

Similarity

N/A

ID: 18487

2-[(6-methylquinazolin-4-yl)amino]acetic acid

$$$$ Data

M. F.

C11H11N3O2

Suppliers	Catalog Number
Matrix Scientific	020626

Database	Data ID
PubChem	721018

M. W.

217.22394

CAS

Similarity

N/A

ID: 18488

2-bromo-N-(6-methylpyridin-2-yl)acetamide

$$$$ Data

M. F.

C8H9BrN2O

Suppliers	Catalog Number
Matrix Scientific	020627

Database	Data ID
PubChem	3415834

M. W.

229.07386

CAS

Similarity

N/A

ID: 18489

3-[(diethylamino)methyl]-4-methoxybenzaldehyde

$$$$ Data

M. F.

C13H19NO2

Suppliers	Catalog Number
ChemBridge	4004183
Matrix Scientific	020628
Enamine	EN300-92253

Database	Data ID
PubChem	590897

M. W.

221.29546

CAS

128501-82-6

Similarity

N/A

ID: 18490

4-hydroxy-6-methyl-2-(piperidin-1-yl)pyrimidine-5-carbaldehyde

$$$$ Data

M. F.

C11H15N3O2

Suppliers	Catalog Number
Matrix Scientific	020629

Database	Data ID
PubChem	778701

M. W.

221.2557

CAS

Similarity

N/A

ID: 18491

N-[(4-methoxyphenyl)methyl]-1,2,5-trimethylpiperidin-4-amine hydrochloride

$$$$ Data

M. F.

C16H27ClN2O

Suppliers	Catalog Number
Matrix Scientific	020630

Database	Data ID
PubChem	45075175

M. W.

298.85138

CAS

Similarity

N/A

ID: 18492

3-(1H-imidazol-1-ylmethyl)-4-propoxybenzaldehyde

$$$$ Data

M. F.

C14H16N2O2

Suppliers	Catalog Number
Matrix Scientific	020631

Database	Data ID
PubChem	6483800

M. W.

244.28904

CAS

Similarity

N/A

ID: 18493

3-[(dimethylamino)methyl]-4-propoxybenzaldehyde

$$$$ Data

M. F.

C13H19NO2

Suppliers	Catalog Number
Matrix Scientific	020632

Database	Data ID
PubChem	6483801

M. W.

221.29546

CAS

Similarity

N/A

ID: 18494

3-[(diethylamino)methyl]-4-propoxybenzaldehyde

$$$$ Data

M. F.

C15H23NO2

Suppliers	Catalog Number
Matrix Scientific	020633

Database	Data ID
PubChem	6483802

M. W.

249.34862

CAS

Similarity

N/A

ID: 18495

3-propoxypiperidine

$$$$ Data

M. F.

C8H17NO

Suppliers	Catalog Number
ChemBridge	4011110
Matrix Scientific	020636
Enamine	EN300-52498

Database	Data ID
PubChem	4712034

M. W.

143.22668

CAS

89122-72-5

Similarity

N/A

ID: 18496

1-[2-(3-methoxyphenoxy)ethyl]-1H-pyrrole-2-carbaldehyde

$$$$ Data

M. F.

C14H15NO3

Suppliers	Catalog Number
Matrix Scientific	020637

Database	Data ID
PubChem	6487521

M. W.

245.2738

CAS

Similarity

N/A

ID: 18497

4-methylthiophene-2-carboxylic acid

$$$$ Data More

M. F.

C6H6O2S

Suppliers	Catalog Number
Sigma Aldrich	633550
Matrix Scientific	020639
Maybridge	GK01984

Database	Data ID
PubChem	2794584

M. W.

142.17564

CAS

14282-78-1

Similarity

N/A

ID: 18498

3-methylpyridine-4-carboxylic acid

$$$$ Data More

M. F.

C7H7NO2

Suppliers	Catalog Number
Matrix Scientific	020640
TRC	M323315
Bide Pharmatech	BD88079

Database	Data ID
PubChem	1502003

M. W.

137.13598

CAS

4021-12-9

Similarity

N/A

ID: 18499

3-(2,2-dimethylpropanamido)thiophene-2-carboxylic acid

$$$$ Data

M. F.

C10H13NO3S

Suppliers	Catalog Number
Matrix Scientific	020641
Key Organics	5H-372S

Database	Data ID
PubChem	2764039

M. W.

227.28012

CAS

Similarity

N/A

ID: 18500

2-(dimethyl-1,3-thiazol-5-yl)acetic acid

$$$$ Data More

M. F.

C7H9NO2S

Suppliers	Catalog Number
ChemBridge	4402640
Matrix Scientific	020642
Life Chemicals	F3099-7071

Database	Data ID
PubChem	214799

M. W.

171.21686

CAS

34272-65-6

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified