Chembase list of 866358 unique molecular structures

ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate

$$$$ Data

M. F.

C9H14O3

Suppliers	Catalog Number
Apollo Scientific	OR30415
TRC	M294520

Database	Data ID
PubChem	82467

M. W.

170.20566

CAS

10226-28-5

Similarity

N/A

ID: 87152

6-methyl-3,4-dihydro-2H-pyran-5-carboxylic acid

$$$$ Data

M. F.

C7H10O3

Suppliers	Catalog Number
Apollo Scientific	OR30416
Enamine	EN300-118537

Database	Data ID
PubChem	79390

M. W.

142.1525

CAS

5399-21-3

Similarity

N/A

ID: 87153

9,10-dibromoanthracene

$$$$ Data More

M. F.

C14H8Br2

Suppliers	Catalog Number
Sigma Aldrich	D38855
MP Biomedicals	05207694
Alfa Aesar	L12680

Database	Data ID
PubChem	68226

M. W.

336.02132

CAS

523-27-3

Similarity

N/A

ID: 87154

3-bromo-1-ethyl-1H,4H,7H-[1,3]dioxolo[4,5-g]cinnolin-4-one

$$$$ Data

M. F.

C11H9BrN2O3

Suppliers	Catalog Number
Apollo Scientific	OR30418

Database	Data ID
PubChem	94107

M. W.

297.10476

CAS

Similarity

N/A

ID: 87155

ethyl 2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylate

$$$$ Data

M. F.

C11H13N3O2

Suppliers	Catalog Number
Apollo Scientific	OR3042

Database	Data ID
PubChem	2736420

M. W.

219.23982

CAS

Similarity

N/A

ID: 87156

5-hydroxybenzene-1,2,4-tricarboxylic acid

$$$$ Data

M. F.

C9H6O7

Suppliers	Catalog Number
Apollo Scientific	OR30420

Database	Data ID
PubChem	2801765

M. W.

226.13974

CAS

Similarity

N/A

ID: 87157

{[(5-nitrofuran-2-yl)methyl]sulfanyl}methanimidamide hydrobromide

$$$$ Data

M. F.

C6H8BrN3O3S

Suppliers	Catalog Number
Apollo Scientific	OR30422

Database	Data ID
PubChem	2801769

M. W.

282.11502

CAS

82118-18-1

Similarity

N/A

ID: 87158

1H-1,2,3-benzotriazol-1-ylmethanol

$$$$ Data

M. F.

C7H7N3O

Suppliers	Catalog Number
Sigma Aldrich	410233
Apollo Scientific	OR30424

Database	Data ID
PubChem	224169

M. W.

149.14998

CAS

28539-02-8

Similarity

N/A

ID: 87159

2-chloro-2-cyclohexylcyclohexan-1-one

$$$$ Data

M. F.

C12H19ClO

Suppliers	Catalog Number
Apollo Scientific	OR30426

Database	Data ID
PubChem	2801775

M. W.

214.73166

CAS

Similarity

N/A

ID: 87160

4-[5-chloro-2-(4-hydroxy-3,5-dimethylphenyl)pentan-2-yl]-2,6-dimethylphenol

$$$$ Data

M. F.

C21H27ClO2

Suppliers	Catalog Number
Apollo Scientific	OR30427

Database	Data ID
PubChem	2801778

M. W.

346.89088

CAS

Similarity

N/A

ID: 87161

sodium 2-oxo-6-phenylhexa-3,5-dienoate

$$$$ Data

M. F.

C12H9NaO3

Suppliers	Catalog Number
Apollo Scientific	OR30428

Database	Data ID
PubChem	5713148

M. W.

224.18783

CAS

Similarity

N/A

ID: 87162

oxane-2,4,6-trione

$$$$ Data

M. F.

C5H4O4

Suppliers	Catalog Number
Apollo Scientific	OR30430

Database	Data ID
PubChem	12439073

M. W.

128.08286

CAS

10521-08-1

Similarity

N/A

ID: 87163

1-(anthracen-9-yl)ethan-1-one

$$$$ Data More

M. F.

C16H12O

Suppliers	Catalog Number
Sigma Aldrich	A12607
MP Biomedicals	05202375
Alfa Aesar	L01278

Database	Data ID
PubChem	69911

M. W.

220.26588

CAS

784-04-3

Similarity

N/A

ID: 87164

2-oxoethyl acetate

$$$$ Data

M. F.

C4H6O3

Suppliers	Catalog Number
Apollo Scientific	OR30432

Database	Data ID
PubChem	11115995

M. W.

102.08864

CAS

5371-49-3

Similarity

N/A

ID: 87165

N-(3-acetylphenyl)-N-methylacetamide

$$$$ Data

M. F.

C11H13NO2

Suppliers	Catalog Number
Apollo Scientific	OR30433
Bide Pharmatech	BD141107

Database	Data ID
PubChem	11159822

M. W.

191.22642

CAS

325715-13-7

Similarity

N/A

ID: 87166

3-methoxyprop-1-ene

$$$$ Data More

M. F.

C4H8O

Suppliers	Catalog Number
Sigma Aldrich	678201
MP Biomedicals	05207647
Alfa Aesar	18652

Database	Data ID
PubChem	69392

M. W.

72.10572

CAS

627-40-7

Similarity

N/A

ID: 87167

(1R)-2,3-dihydro-1H-inden-1-amine

$$$$ Data More

M. F.

C9H11N

Suppliers	Catalog Number
Sigma Aldrich	726737 445347 08233
Alfa Aesar	L19302
Apollo Scientific	OR30437

Database	Data ID
PubChem	2733933

M. W.

133.19034

CAS

10277-74-4

Similarity

N/A

ID: 87168

8-aminonaphthalen-2-ol

$$$$ Data More

M. F.

C10H9NO

Suppliers	Catalog Number
Sigma Aldrich	536911
Apollo Scientific	OR30443
Enamine	EN300-101107

Database	Data ID
PubChem	8358

M. W.

159.18456

CAS

118-46-7

Similarity

N/A

ID: 87169

5-amino-1,2,3,4-tetrahydrophthalazine-1,4-dione hydrochloride

$$$$ Data

M. F.

C8H8ClN3O2

Suppliers	Catalog Number
Apollo Scientific	OR30444

Database	Data ID
PubChem	24802270

M. W.

213.62102

CAS

74165-64-3

Similarity

N/A

ID: 87170

8-amino-2-sodio-1,2,3,4-tetrahydrophthalazine-1,4-dione hydrate

$$$$ Data

M. F.

C8H8N3NaO3

Suppliers	Catalog Number
Apollo Scientific	OR30445

Database	Data ID
PubChem	44119319

M. W.

217.15719

CAS

206658-90-4

Similarity

N/A

ID: 87171

4-aminobenzene-1,2-dicarboxylic acid

$$$$ Data More

M. F.

C8H7NO4

Suppliers	Catalog Number
Sigma Aldrich	524716
MP Biomedicals	05214974
Alfa Aesar	L03333

Database	Data ID
PubChem	72912

M. W.

181.14548

CAS

5434-21-9

Similarity

N/A

ID: 87172

2-(propane-1-sulfonyl)aniline

$$$$ Data

M. F.

C9H13NO2S

Suppliers	Catalog Number
Apollo Scientific	OR30447

Database	Data ID
PubChem	3018670

M. W.

199.27002

CAS

76697-58-0

Similarity

N/A

ID: 87173

2-aminobenzene-1,4-dicarboxylic acid

$$$$ Data More

M. F.

C8H7NO4

Suppliers	Catalog Number
Sigma Aldrich	381071 09437
Alfa Aesar	B24441
Apollo Scientific	OR30450

Database	Data ID
PubChem	2724822

M. W.

181.14548

CAS

10312-55-7

Similarity

N/A

ID: 87174

anthracene-9-carbonyl chloride

$$$$ Data

M. F.

C15H9ClO

Suppliers	Catalog Number
Apollo Scientific	OR30452

Database	Data ID
PubChem	167528

M. W.

240.68436

CAS

16331-52-5

Similarity

N/A

ID: 87175

benzenecarboximidamide hydrochloride

$$$$ Data More

M. F.

C7H9ClN2

Suppliers	Catalog Number
Sigma Aldrich	63226 434760
MP Biomedicals	05211069
Alfa Aesar	A16002

Database	Data ID
PubChem	80289

M. W.

156.61276

CAS

1670-14-0

Similarity

N/A

ID: 87176

1-(benzyloxy)-4-(chloromethyl)benzene

$$$$ Data

M. F.

C14H13ClO

Suppliers	Catalog Number
Sigma Aldrich	114081 13629
MP Biomedicals	05223877
Apollo Scientific	OR30457

Database	Data ID
PubChem	70042

M. W.

232.70542

CAS

836-42-0

Similarity

N/A

ID: 87177

1-benzyl-1-phenylhydrazine hydrochloride

$$$$ Data

M. F.

C13H15ClN2

Suppliers	Catalog Number
Alfa Aesar	A17367
Apollo Scientific	OR30458
Enamine	EN300-36456

Database	Data ID
PubChem	79785

M. W.

234.7246

CAS

5705-15-7

Similarity

N/A

ID: 87178

4-(4-sulfophenyl)benzene-1-sulfonic acid

$$$$ Data

M. F.

C12H10O6S2

Suppliers	Catalog Number
Apollo Scientific	OR30459

Database	Data ID
PubChem	79202

M. W.

314.3342

CAS

5314-37-4

Similarity

N/A

ID: 87179

4-{[4-(chlorosulfonyl)phenyl]disulfanyl}benzene-1-sulfonyl chloride

$$$$ Data

M. F.

C12H8Cl2O4S4

Suppliers	Catalog Number
Apollo Scientific	OR30460

Database	Data ID
PubChem	22351639

M. W.

415.35552

CAS

27738-91-6

Similarity

N/A

ID: 87180

4-bromobenzene-1-sulfonic acid

$$$$ Data

M. F.

C6H5BrO3S

Suppliers	Catalog Number
Apollo Scientific	OR30463

Database	Data ID
PubChem	78717

M. W.

237.0711

CAS

79326-93-5

Similarity

N/A

ID: 87181

sodium 2-bromoethane-1-sulfonate

$$$$ Data More

M. F.

C2H4BrNaO3S

Suppliers	Catalog Number
Sigma Aldrich	137502 16151
MP Biomedicals	05214358
Alfa Aesar	A15076

Database	Data ID
PubChem	23666797

M. W.

211.01013

CAS

4263-52-9

Similarity

N/A

ID: 87182

5-bromo-6-isothiocyanatoquinoxaline

$$$$ Data

M. F.

C9H4BrN3S

Suppliers	Catalog Number
Apollo Scientific	OR30467
TRC	B684495

Database	Data ID
PubChem	4460274

M. W.

266.11716

CAS

134892-46-9

Similarity

N/A

ID: 87183

4-bromo-7-methyl-2,3-dihydro-1H-indole-2,3-dione

$$$$ Data

M. F.

C9H6BrNO2

Suppliers	Catalog Number
Apollo Scientific	OR30468
Enamine	EN300-78101
A&J Pharmtech	AJA-O29453

Database	Data ID
PubChem	24721366

M. W.

240.05344

CAS

874375-17-4

Similarity

N/A

ID: 87184

5-bromo-5-nitro-1,3-dioxane

$$$$ Data More

M. F.

C4H6BrNO4

Suppliers	Catalog Number
Sigma Aldrich	B8791 34391
Apollo Scientific	OR30469
Chemik	CHH19700

Database	Data ID
Wikipedia	Bronidox
PubChem	1807

M. W.

211.99874

CAS

30007-47-7

Similarity

N/A

ID: 87185

(5-bromoquinoxalin-6-yl)thiourea

$$$$ Data

M. F.

C9H7BrN4S

Suppliers	Catalog Number
Apollo Scientific	OR30470
TRC	B686940

Database	Data ID
PubChem	26966634

M. W.

283.14768

CAS

842138-74-3

Similarity

N/A

ID: 87186

sodium 6-bromo-2-hydroxy-1,2,3,4-tetrahydronaphthalene-2-sulfonate

$$$$ Data

M. F.

C10H10BrNaO4S

Suppliers	Catalog Number
Apollo Scientific	OR30471

Database	Data ID
PubChem	44119135

M. W.

329.14277

CAS

Similarity

N/A

ID: 87187

butyl 2-isocyanatoacetate

$$$$ Data More

M. F.

C7H11NO3

Suppliers	Catalog Number
Sigma Aldrich	482889
MP Biomedicals	05213185
Alfa Aesar	41985

Database	Data ID
PubChem	86921

M. W.

157.16714

CAS

17046-22-9

Similarity

N/A

ID: 87188

2-{[(1-hydroxyprop-2-yn-1-yl)oxy]carbonyl}benzoic acid

$$$$ Data

M. F.

C11H8O5

Suppliers	Catalog Number
Apollo Scientific	OR30473

Database	Data ID
PubChem	44119320

M. W.

220.17822

CAS

42969-62-0

Similarity

N/A

ID: 87189

4-chlorobenzene-1-sulfonamide

$$$$ Data More

M. F.

C6H6ClNO2S

Suppliers	Catalog Number
Sigma Aldrich	C24191 09617
MP Biomedicals	05204272
Alfa Aesar	A16735

Database	Data ID
PubChem	66824

M. W.

191.63534

CAS

98-64-6

Similarity

N/A

ID: 87190

4-(piperidin-1-yl)piperidine-1-carbonyl chloride hydrochloride

$$$$ Data

M. F.

C11H20Cl2N2O

Suppliers	Catalog Number
Apollo Scientific	OR30477
Bide Pharmatech	BD18331

Database	Data ID
PubChem	11637553

M. W.

267.1953

CAS

143254-82-4

Similarity

N/A

ID: 87191

4-chloro-3-ethylphenol

$$$$ Data

M. F.

C8H9ClO

Suppliers	Catalog Number
Sigma Aldrich	279552
Apollo Scientific	OR30478
Enamine	EN300-21414

Database	Data ID
PubChem	84223

M. W.

156.60946

CAS

14143-32-9

Similarity

N/A

ID: 87192

4-chloro-2-iodophenol

$$$$ Data

M. F.

C6H4ClIO

Suppliers	Catalog Number
Apollo Scientific	OR30481
Bide Pharmatech	BD95754
A&J Pharmtech	AJA-O9066

Database	Data ID
PubChem	620234

M. W.

254.45283

CAS

71643-66-8

Similarity

N/A

ID: 87193

6-chloro-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione

$$$$ Data More

M. F.

C8H4ClNO3

Suppliers	Catalog Number
Sigma Aldrich	C48104
Apollo Scientific	OR30482
Life Chemicals	F0074-0091

Database	Data ID
PubChem	78480

M. W.

197.57526

CAS

4743-17-3

Similarity

N/A

ID: 87194

3-chloro-2,5-dihydrofuran-2,5-dione

$$$$ Data

M. F.

C4HClO3

Suppliers	Catalog Number
Apollo Scientific	OR30483

Database	Data ID
PubChem	66772

M. W.

132.50194

CAS

96-02-6

Similarity

N/A

ID: 87195

7-chloro-3-methyl-1-benzothiophene

$$$$ Data

M. F.

C9H7ClS

Suppliers	Catalog Number
Apollo Scientific	OR30484
TRC	C369380

Database	Data ID
PubChem	20242118

M. W.

182.66988

CAS

17514-68-0

Similarity

N/A

ID: 87196

cyclobutanone

$$$$ Data More

M. F.

C4H6O

Suppliers	Catalog Number
Sigma Aldrich	C96001 28696
ChemBridge	4034698
MP Biomedicals	05203906

Database	Data ID
PubChem	14496

M. W.

70.08984

CAS

1191-95-3

Similarity

N/A

ID: 87197

2-cyclohexyl-1,4-dihydronaphthalene-1,4-dione

$$$$ Data

M. F.

C16H16O2

Suppliers	Catalog Number
Apollo Scientific	OR30489

Database	Data ID
PubChem	259760

M. W.

240.29704

CAS

34987-31-0

Similarity

N/A

ID: 87198

3-hydroxypropanenitrile

$$$$ Data More

M. F.

C3H5NO

Suppliers	Catalog Number
Sigma Aldrich	C6773 109924 236357 (more...)
MP Biomedicals	05215859 02154998
Alfa Aesar	L12570

Database	Data ID
PubChem	8011

M. W.

71.0779

CAS

109-78-4

Similarity

N/A

ID: 87199

2,5-dibromobenzene-1,4-diol

$$$$ Data More

M. F.

C6H4Br2O2

Suppliers	Catalog Number
Sigma Aldrich	574619
Alfa Aesar	H55453
Apollo Scientific	OR30490

Database	Data ID
PubChem	280945

M. W.

267.90276

CAS

14753-51-6

Similarity

N/A

ID: 87200

diethyl 4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl phosphate

$$$$ Data More

M. F.

C11H14N3O5P

Suppliers	Catalog Number
Sigma Aldrich	495964
Alfa Aesar	H26481
Apollo Scientific	OR30492

Database	Data ID
PubChem	4293995

M. W.

299.219721

CAS

165534-43-0

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