Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C9H9NO4

Suppliers	Catalog Number
Apollo Scientific	OR17822

Database	Data ID
PubChem	3314122

M. W.

195.17206

CAS

20587-30-8

Similarity

N/A

ID: 78202

4-(4-bromophenyl)morpholine

$$$$ Data

M. F.

C10H12BrNO

Suppliers	Catalog Number
Sigma Aldrich	591777
Apollo Scientific	OR17823
A&J Pharmtech	AJA-O3097

Database	Data ID
PubChem	11622851

M. W.

242.11238

CAS

30483-75-1

Similarity

N/A

ID: 78203

sodium 2-amino-4-sulfobenzene-1-sulfonate

$$$$ Data

M. F.

C6H6NNaO6S2

Suppliers	Catalog Number
Apollo Scientific	OR17827

Database	Data ID
PubChem	44118805

M. W.

275.23471

CAS

24605-36-5

Similarity

N/A

ID: 78204

2-bromo-1-(quinolin-8-yl)ethan-1-one hydrobromide

$$$$ Data

M. F.

C11H9Br2NO

Suppliers	Catalog Number
Apollo Scientific	OR17828
A&J Pharmtech	AJA-O9181

Database	Data ID
PubChem	44118665

M. W.

331.00326

CAS

859962-48-4

Similarity

N/A

ID: 78205

propane-2-sulfonamide

$$$$ Data

M. F.

C3H9NO2S

Suppliers	Catalog Number
Apollo Scientific	OR17829
Enamine	EN300-57289
Bide Pharmatech	BD226515

Database	Data ID
PubChem	3549191

M. W.

123.17406

CAS

81363-76-0

Similarity

N/A

ID: 78206

2H,3H-thieno[3,4-b][1,4]dioxine

$$$$ Data More

M. F.

C6H6O2S

Suppliers	Catalog Number
Sigma Aldrich	483028
Alfa Aesar	H56533
Apollo Scientific	OR17830

Database	Data ID
PubChem	4421864

M. W.

142.17564

CAS

126213-50-1

Similarity

N/A

ID: 78207

2,5-dibromo-3-hexylthiophene

$$$$ Data

M. F.

C10H14Br2S

Suppliers	Catalog Number
Sigma Aldrich	456373
Apollo Scientific	OR17832

Database	Data ID
PubChem	3936632

M. W.

326.09116

CAS

116971-11-0

Similarity

N/A

ID: 78208

5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)-1,4,5,6-tetrahydropyrimidine-4,6-dione

$$$$ Data

M. F.

C15H12N4O4

Suppliers	Catalog Number
Apollo Scientific	OR17834
Bide Pharmatech	BD100701

Database	Data ID
PubChem	11109730

M. W.

312.28018

CAS

150728-12-4

Similarity

N/A

ID: 78209

(2-methylpyrimidin-5-yl)methanol

$$$$ Data

M. F.

C6H8N2O

Suppliers	Catalog Number
Apollo Scientific	OR17837
Bide Pharmatech	BD19486
A&J Pharmtech	AJA-O21967

Database	Data ID
PubChem	14686706

M. W.

124.14052

CAS

2239-83-0

Similarity

N/A

ID: 78210

tert-butyl N-[5-(aminomethyl)pyridin-2-yl]carbamate

$$$$ Data

M. F.

C11H17N3O2

Suppliers	Catalog Number
Alfa Aesar	H50078
Apollo Scientific	OR17840
A&J Pharmtech	AJA-O14385

Database	Data ID
PubChem	42553118

M. W.

223.27158

CAS

187237-37-2

Similarity

N/A

ID: 78211

2-(bromomethyl)quinoline

$$$$ Data

M. F.

C10H8BrN

Suppliers	Catalog Number
Sigma Aldrich	727520
Apollo Scientific	OR17841
Bide Pharmatech	BD62939

Database	Data ID
PubChem	12417418

M. W.

222.08122

CAS

5632-15-5

Similarity

N/A

ID: 78212

2-bromo-1-(quinolin-8-yl)ethan-1-one

$$$$ Data

M. F.

C11H8BrNO

Suppliers	Catalog Number
Apollo Scientific	OR17843

Database	Data ID
PubChem	14742523

M. W.

250.09132

CAS

Similarity

N/A

ID: 78213

4-(3,5-dimethyl-1H-pyrazol-1-yl)benzene-1-sulfonyl chloride

$$$$ Data

M. F.

C11H11ClN2O2S

Suppliers	Catalog Number
Maybridge	CC68203
Apollo Scientific	OR17844

Database	Data ID
PubChem	12292093

M. W.

270.73524

CAS

61320-20-5

Similarity

N/A

ID: 78214

6-phenylpyridine-3-sulfonyl chloride

$$$$ Data

M. F.

C11H8ClNO2S

Suppliers	Catalog Number
Maybridge	CC21103
Apollo Scientific	OR17846

Database	Data ID
PubChem	24229463

M. W.

253.70472

CAS

884507-12-4

Similarity

N/A

ID: 78215

4-methyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazine-7-sulfonyl chloride

$$$$ Data

M. F.

C8H9ClN2O3S

Suppliers	Catalog Number
Maybridge	CC62003
Apollo Scientific	OR17847

Database	Data ID
PubChem	24229646

M. W.

248.68666

CAS

910037-13-7

Similarity

N/A

ID: 78216

9-ethyl-9H-carbazole-3-carbaldehyde

$$$$ Data More

M. F.

C15H13NO

Suppliers	Catalog Number
Sigma Aldrich	151483
Apollo Scientific	OR17849
Enamine	EN300-18131

Database	Data ID
PubChem	82055

M. W.

223.26982

CAS

7570-45-8

Similarity

N/A

ID: 78217

1-[(2-aminophenyl)methyl]-1H-pyrrole-2-carbonitrile

$$$$ Data

M. F.

C12H11N3

Suppliers	Catalog Number
Apollo Scientific	OR17855

Database	Data ID
PubChem	1485662

M. W.

197.23584

CAS

23208-04-0

Similarity

N/A

ID: 78218

5,7-dichloro-2,1,3-benzothiadiazol-4-amine

$$$$ Data

M. F.

C6H3Cl2N3S

Suppliers	Catalog Number
Apollo Scientific	OR17856

Database	Data ID
PubChem	305681

M. W.

220.07912

CAS

Similarity

N/A

ID: 78219

4-amino-N-methoxy-N-methylbenzene-1-sulfonamide

$$$$ Data

M. F.

C8H12N2O3S

Suppliers	Catalog Number
Apollo Scientific	OR17857
Enamine	EN300-13806

Database	Data ID
PubChem	4962658

M. W.

216.25748

CAS

33529-48-5

Similarity

N/A

ID: 78220

methyl 2-[(4-aminophenyl)formamido]acetate hydrochloride

$$$$ Data

M. F.

C10H13ClN2O3

Suppliers	Catalog Number
Apollo Scientific	OR17858
Enamine	EN300-14069

Database	Data ID
PubChem	16232242

M. W.

244.67482

CAS

5259-86-9

Similarity

N/A

ID: 78221

2-[(thiophen-3-ylmethyl)sulfanyl]aniline

$$$$ Data

M. F.

C11H11NS2

Suppliers	Catalog Number
Apollo Scientific	OR17859
Enamine	EN300-15313

Database	Data ID
PubChem	7064089

M. W.

221.34174

CAS

114461-58-4

Similarity

N/A

ID: 78222

5-[(E)-2-(2,5-dihydroxyphenyl)ethenyl]-2-hydroxybenzoic acid

$$$$ Data

M. F.

C15H12O5

Suppliers	Catalog Number
Apollo Scientific	OR1785T
TRC	C178500

Database	Data ID
PubChem	5353259

M. W.

272.25278

CAS

150258-63-2

Similarity

N/A

ID: 78223

4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]aniline

$$$$ Data

M. F.

C10H11N3S

Suppliers	Catalog Number
Apollo Scientific	OR17863
Enamine	EN300-25626

Database	Data ID
PubChem	609601

M. W.

205.27944

CAS

96591-94-5

Similarity

N/A

ID: 78224

3-amino-N-cyclopropyl-4-methoxybenzene-1-sulfonamide

$$$$ Data

M. F.

C10H14N2O3S

Suppliers	Catalog Number
Apollo Scientific	OR17864
Enamine	EN300-27344

Database	Data ID
PubChem	16227903

M. W.

242.29476

CAS

929973-72-8

Similarity

N/A

ID: 78225

2-(1H-1,2,4-triazol-1-yl)aniline

$$$$ Data

M. F.

C8H8N4

Suppliers	Catalog Number
Apollo Scientific	OR17866
Enamine	EN300-30614

Database	Data ID
PubChem	10749486

M. W.

160.17592

CAS

Similarity

N/A

ID: 78226

2-(1,3,4-oxadiazol-2-yl)aniline

$$$$ Data

M. F.

C8H7N3O

Suppliers	Catalog Number
ChemBridge	4033864
Apollo Scientific	OR17867

Database	Data ID
PubChem	13409725

M. W.

161.16068

CAS

90004-05-0

Similarity

N/A

ID: 78227

1-N-(3-methylphenyl)benzene-1,2-diamine

$$$$ Data

M. F.

C13H14N2

Suppliers	Catalog Number
Apollo Scientific	OR17869

Database	Data ID
PubChem	40425440

M. W.

198.26366

CAS

Similarity

N/A

ID: 78228

2-(morpholin-4-yl)-1,3-benzoxazol-5-amine

$$$$ Data

M. F.

C11H13N3O2

Suppliers	Catalog Number
Apollo Scientific	OR17870

Database	Data ID
PubChem	16768943

M. W.

219.23982

CAS

Similarity

N/A

ID: 78229

1-ethynyl-2-nitrobenzene

$$$$ Data

M. F.

C8H5NO2

Suppliers	Catalog Number
Sigma Aldrich	519456
Apollo Scientific	OR17873
A&J Pharmtech	AJA-O40408

Database	Data ID
PubChem	1493957

M. W.

147.1308

CAS

16433-96-8

Similarity

N/A

ID: 78230

1-ethynyl-2-iodobenzene

$$$$ Data

M. F.

C8H5I

Suppliers	Catalog Number
Apollo Scientific	OR17874

Database	Data ID
PubChem	11345197

M. W.

228.02977

CAS

766-50-7

Similarity

N/A

ID: 78231

2-ethynylbenzoic acid

$$$$ Data

M. F.

C9H6O2

Suppliers	Catalog Number
Apollo Scientific	OR17875

Database	Data ID
PubChem	12688470

M. W.

146.14274

CAS

33578-00-6

Similarity

N/A

ID: 78232

2-ethynylbenzonitrile

$$$$ Data

M. F.

C9H5N

Suppliers	Catalog Number
Apollo Scientific	OR17876

Database	Data ID
PubChem	11116074

M. W.

127.1427

CAS

40888-26-4

Similarity

N/A

ID: 78233

3-ethynylbenzonitrile

$$$$ Data

M. F.

C9H5N

Suppliers	Catalog Number
Apollo Scientific	OR17877
A&J Pharmtech	AJA-O24603

Database	Data ID
PubChem	12088964

M. W.

127.1427

CAS

171290-53-2

Similarity

N/A

ID: 78234

2-{[4-(dimethylamino)phenyl]methylidene}propanedinitrile

$$$$ Data

M. F.

C12H11N3

Suppliers	Catalog Number
Apollo Scientific	OR17878

Database	Data ID
PubChem	137736

M. W.

197.23584

CAS

Similarity

N/A

ID: 78235

4-[4-(dimethylamino)phenyl]-2-(4-nitrophenyl)but-3-enenitrile

$$$$ Data

M. F.

C18H17N3O2

Suppliers	Catalog Number
Apollo Scientific	OR17879

Database	Data ID
PubChem	71300045

M. W.

307.34648

CAS

Similarity

N/A

ID: 78236

2-[(2-nitrophenyl)methylidene]propanedinitrile

$$$$ Data

M. F.

C10H5N3O2

Suppliers	Catalog Number
Apollo Scientific	OR17880

Database	Data ID
PubChem	17796

M. W.

199.1656

CAS

Similarity

N/A

ID: 78237

potassium (4-hydrazinylphenyl)dihydroxy-$l^{4}-sulfanolate

$$$$ Data

M. F.

C6H9KN2O3S

Suppliers	Catalog Number
Apollo Scientific	OR17881

Database	Data ID
PubChem	44118657

M. W.

228.31056

CAS

Similarity

N/A

ID: 78238

methyl (2R,4R)-4-hydroxypyrrolidine-2-carboxylate hydrochloride

$$$$ Data

M. F.

C6H12ClNO3

Suppliers	Catalog Number
Apollo Scientific	OR17882 OR17883
Bide Pharmatech	BD165788
A&J Pharmtech	AJA-O929

Database	Data ID
PubChem	12764090

M. W.

181.61738

CAS

481704-21-6

Similarity

N/A

ID: 78239

bis(tri-tert-butylphosphane) palladium

$$$$ Data

M. F.

C24H54P2Pd

Suppliers	Catalog Number
Sigma Aldrich	676578
Alfa Aesar	44845
Apollo Scientific	OR17884

Database	Data ID
PubChem	2734558

M. W.

511.053082

CAS

53199-31-8

Similarity

N/A

ID: 78240

tri-tert-butylphosphane

$$$$ Data

M. F.

C12H27P

Suppliers	Catalog Number
Sigma Aldrich	336955 655325 570958 (more...)
Alfa Aesar	10178
Apollo Scientific	OR17885A OR17885

Database	Data ID
PubChem	83681

M. W.

202.316541

CAS

13716-12-6

Similarity

N/A

ID: 78241

5,5-dimethylimidazolidine-2,4-dione

$$$$ Data More

M. F.

C5H8N2O2

Suppliers	Catalog Number
Sigma Aldrich	D161403 40670
MP Biomedicals	02157823 05212870
Alfa Aesar	L03388

Database	Data ID
PubChem	6491

M. W.

128.12922

CAS

77-71-4

Similarity

N/A

ID: 78242

ethyl cyanoformate

$$$$ Data More

M. F.

C4H5NO2

Suppliers	Catalog Number
Sigma Aldrich	E18859 28317
MP Biomedicals	05220939
Alfa Aesar	L15777

Database	Data ID
PubChem	69336

M. W.

99.088

CAS

623-49-4

Similarity

N/A

ID: 78243

2-[(4-bromophenyl)methyl]-1,3-thiazole-4-carboxylic acid

$$$$ Data

M. F.

C11H8BrNO2S

Suppliers	Catalog Number
Apollo Scientific	OR17895

Database	Data ID
PubChem	28875559

M. W.

298.15572

CAS

Similarity

N/A

ID: 78244

2-[(3-methoxyphenyl)methyl]-1,3-thiazole-4-carboxylic acid

$$$$ Data

M. F.

C12H11NO3S

Suppliers	Catalog Number
Apollo Scientific	OR17896

Database	Data ID
PubChem	28875563

M. W.

249.28564

CAS

Similarity

N/A

ID: 78245

2-[(2-bromophenyl)methyl]-1,3-thiazole-4-carboxylic acid

$$$$ Data

M. F.

C11H8BrNO2S

Suppliers	Catalog Number
Apollo Scientific	OR17897

Database	Data ID
PubChem	28875561

M. W.

298.15572

CAS

Similarity

N/A

ID: 78246

2-(2H-1,3-benzodioxol-5-yl)-1,3-thiazolidine-4-carboxylic acid

$$$$ Data

M. F.

C11H11NO4S

Suppliers	Catalog Number
Apollo Scientific	OR17899

Database	Data ID
PubChem	2756583

M. W.

253.27434

CAS

Similarity

N/A

ID: 78247

ethyl(methyl){tris[ethyl(methyl)amino]zirconio}amine

$$$$ Data

M. F.

C12H32N4Zr

Suppliers	Catalog Number
Sigma Aldrich	725528 553131
Apollo Scientific	OR17900

Database	Data ID
PubChem	4446313

M. W.

323.63328

CAS

175923-04-3

Similarity

N/A

ID: 78248

dimethyl[tris(dimethylamino)hafnio]amine

$$$$ Data

M. F.

C8H24HfN4

Suppliers	Catalog Number
Sigma Aldrich	455199 666610
Apollo Scientific	OR17901

Database	Data ID
PubChem	140609

M. W.

354.79296

CAS

19782-68-4

Similarity

N/A

ID: 78249

ethyl(methyl){tris[ethyl(methyl)amino]hafnio}amine

$$$$ Data

M. F.

C12H32HfN4

Suppliers	Catalog Number
Sigma Aldrich	553123 725544
Apollo Scientific	OR17902

Database	Data ID
PubChem	4103752

M. W.

410.89928

CAS

352535-01-4

Similarity

N/A

ID: 78250

diethyl[tris(diethylamino)hafnio]amine

$$$$ Data

M. F.

C16H40HfN4

Suppliers	Catalog Number
Sigma Aldrich	455202
Apollo Scientific	OR17903

Database	Data ID
PubChem	140612

M. W.

467.0056

CAS

19824-55-6

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