Chembase list of 866358 unique molecular structures

2-{[(2-hydroxyphenyl)carbamoyl]methoxy}acetic acid

$$$$ Data

M. F.

C10H11NO5

Suppliers	Catalog Number
Matrix Scientific	035847

Database	Data ID
PubChem	25219061

M. W.

225.19804

CAS

Similarity

N/A

ID: 33102

4-[(2-hydroxyphenyl)carbamoyl]butanoic acid

$$$$ Data

M. F.

C11H13NO4

Suppliers	Catalog Number
Matrix Scientific	035848

Database	Data ID
PubChem	23959190

M. W.

223.22522

CAS

Similarity

N/A

ID: 33103

2-(chloromethyl)-4,5-dimethyl-1H-1,3-benzodiazole

$$$$ Data

M. F.

C10H11ClN2

Suppliers	Catalog Number
ChemBridge	4011038
Matrix Scientific	035849

Database	Data ID
PubChem	22018817

M. W.

194.66074

CAS

405173-68-4

Similarity

N/A

ID: 33104

6-methyl-2-(piperidin-4-yl)-1,3-benzoxazole

$$$$ Data

M. F.

C13H16N2O

Suppliers	Catalog Number
Matrix Scientific	035850

Database	Data ID
PubChem	20983592

M. W.

216.27894

CAS

Similarity

N/A

ID: 33105

1-(5-tert-butyl-1,3-benzoxazol-2-yl)piperidin-4-amine hydrochloride

$$$$ Data

M. F.

C16H24ClN3O

Suppliers	Catalog Number
Matrix Scientific	035851

Database	Data ID
PubChem	44120495

M. W.

309.83426

CAS

Similarity

N/A

ID: 33106

2-(carbamoylmethoxy)acetic acid

$$$$ Data More

M. F.

C4H7NO4

Suppliers	Catalog Number
Sigma Aldrich	CBR00075
ChemBridge	4026979
Matrix Scientific	035852

Database	Data ID
PubChem	4102130

M. W.

133.10268

CAS

22064-40-0

Similarity

N/A

ID: 33107

1-(2-chloroethyl)-2-ethyl-1H-imidazole hydrochloride

$$$$ Data

M. F.

C7H12Cl2N2

Suppliers	Catalog Number
Matrix Scientific	035853

Database	Data ID
PubChem	44118508

M. W.

195.08958

CAS

Similarity

N/A

ID: 33108

4,5-dimethyl-2-(pyrrolidin-2-yl)-1H-1,3-benzodiazole

$$$$ Data

M. F.

C13H17N3

Suppliers	Catalog Number
Matrix Scientific	035854

Database	Data ID
PubChem	25219064

M. W.

215.29418

CAS

Similarity

N/A

ID: 33109

[1-methyl-5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]methanamine

$$$$ Data

M. F.

C10H10F3N3

Suppliers	Catalog Number
ChemBridge	4101285
Matrix Scientific	035855
A&J Pharmtech	AJA-O27124

Database	Data ID
PubChem	16640614

M. W.

229.2017096

CAS

828241-99-2

Similarity

N/A

ID: 33110

5-methyl-1,3,4-oxadiazol-2-amine

$$$$ Data More

M. F.

C3H5N3O

Suppliers	Catalog Number
ChemBridge	4013100
Matrix Scientific	035856
Enamine	EN300-07654

Database	Data ID
PubChem	2060250

M. W.

99.0913

CAS

52838-39-8

Similarity

N/A

ID: 33111

2-[2-(5,7-dichloro-1,3-benzoxazol-2-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione

$$$$ Data

M. F.

C17H10Cl2N2O3

Suppliers	Catalog Number
Matrix Scientific	035857

Database	Data ID
PubChem	25219066

M. W.

361.1789

CAS

Similarity

N/A

ID: 33112

3-[(3-methylphenyl)carbamoyl]propanoic acid

$$$$ Data

M. F.

C11H13NO3

Suppliers	Catalog Number
Matrix Scientific	035858

Database	Data ID
PubChem	763244

M. W.

207.22582

CAS

62134-48-9

Similarity

N/A

ID: 33113

3-(hydrazinecarbonyl)-N-(3-methylphenyl)propanamide

$$$$ Data

M. F.

C11H15N3O2

Suppliers	Catalog Number
Matrix Scientific	035859

Database	Data ID
PubChem	23833505

M. W.

221.2557

CAS

Similarity

N/A

ID: 33114

5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid

$$$$ Data

M. F.

C7H9N3O2

Suppliers	Catalog Number
ChemBridge	3002602
Matrix Scientific	035860
Enamine	EN300-51350

Database	Data ID
PubChem	25219067

M. W.

167.16526

CAS

1035841-07-6

Similarity

N/A

ID: 33115

(5-ethyl-1,3,4-oxadiazol-2-yl)methanamine hydrochloride

$$$$ Data

M. F.

C5H10ClN3O

Suppliers	Catalog Number
Matrix Scientific	035861
Enamine	EN300-118386

Database	Data ID
PubChem	44118438

M. W.

163.6054

CAS

Similarity

N/A

ID: 33116

3-(N'-acetylhydrazinecarbonyl)propanoic acid

$$$$ Data

M. F.

C6H10N2O4

Suppliers	Catalog Number
Matrix Scientific	035862

Database	Data ID
PubChem	25219068

M. W.

174.1546

CAS

Similarity

N/A

ID: 33117

2-(chloromethyl)-6-fluoro-1H-1,3-benzodiazole

$$$$ Data

M. F.

C8H6ClFN2

Suppliers	Catalog Number
Matrix Scientific	035863 058865
A&J Pharmtech	AJA-O22135

Database	Data ID
PubChem	11435356

M. W.

184.5980432

CAS

156144-42-2

Similarity

N/A

ID: 33118

5-fluoro-2-(pyrrolidin-2-yl)-1H-1,3-benzodiazole

$$$$ Data

M. F.

C11H12FN3

Suppliers	Catalog Number
ChemBridge	4001640
Matrix Scientific	035864
A&J Pharmtech	AJA-O30282

Database	Data ID
PubChem	25219069

M. W.

205.2314832

CAS

885277-90-7

Similarity

N/A

ID: 33119

2-(chloromethyl)-5-methyl-1H-1,3-benzodiazole

$$$$ Data

M. F.

C9H9ClN2

Suppliers	Catalog Number
ChemBridge	4087848 4011034
Matrix Scientific	035865
A&J Pharmtech	AJA-O30592 AJA-O28960

Database	Data ID
PubChem	266289

M. W.

180.63416

CAS

80567-68-6

Similarity

N/A

ID: 33120

[(5,6-dimethyl-1H-1,3-benzodiazol-2-yl)methyl](methyl)amine

$$$$ Data

M. F.

C11H15N3

Suppliers	Catalog Number
ChemBridge	4004434
Matrix Scientific	035866

Database	Data ID
PubChem	25219070

M. W.

189.2569

CAS

938458-93-6

Similarity

N/A

ID: 33121

(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}morpholin-2-yl)methanamine dihydrochloride

$$$$ Data

M. F.

C11H16Cl2N4O2

Suppliers	Catalog Number
Matrix Scientific	035867

Database	Data ID
PubChem	44120496

M. W.

307.17634

CAS

Similarity

N/A

ID: 33122

2-(6-chloro-5-methyl-1,3-benzoxazol-2-yl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C10H12Cl2N2O

Suppliers	Catalog Number
Matrix Scientific	035868

Database	Data ID
PubChem	44118439

M. W.

247.12108

CAS

Similarity

N/A

ID: 33123

2-[1-(5-methoxy-1,3-benzoxazol-2-yl)piperidin-3-yl]acetic acid

$$$$ Data

M. F.

C15H18N2O4

Suppliers	Catalog Number
Matrix Scientific	035869

Database	Data ID
PubChem	25219073

M. W.

290.31442

CAS

Similarity

N/A

ID: 33124

2-(5-methyl-1,3-benzoxazol-2-yl)ethan-1-amine

$$$$ Data

M. F.

C10H12N2O

Suppliers	Catalog Number
ChemBridge	3001583
Matrix Scientific	035870

Database	Data ID
PubChem	25219074

M. W.

176.21508

CAS

871688-90-3

Similarity

N/A

ID: 33125

(5-fluoro-1,3-benzoxazol-2-yl)methanamine hydrochloride

$$$$ Data

M. F.

C8H8ClFN2O

Suppliers	Catalog Number
Matrix Scientific	035871

Database	Data ID
PubChem	44118440

M. W.

202.6133232

CAS

Similarity

N/A

ID: 33126

1-(6-chloro-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid

$$$$ Data

M. F.

C13H13ClN2O3

Suppliers	Catalog Number
Matrix Scientific	035872

Database	Data ID
PubChem	25219076

M. W.

280.70692

CAS

Similarity

N/A

ID: 33127

6-chloro-5-methyl-2-(piperidin-4-yl)-1,3-benzoxazole

$$$$ Data

M. F.

C13H15ClN2O

Suppliers	Catalog Number
ChemBridge	3001975
Matrix Scientific	035873

Database	Data ID
PubChem	25219077

M. W.

250.724

CAS

1035840-69-7

Similarity

N/A

ID: 33128

6-chloro-2-(piperazin-1-yl)-1,3-benzoxazole

$$$$ Data

M. F.

C11H12ClN3O

Suppliers	Catalog Number
ChemBridge	3002603
Matrix Scientific	035874

Database	Data ID
PubChem	25219078

M. W.

237.68548

CAS

914299-71-1

Similarity

N/A

ID: 33129

1-(1,3-benzoxazol-2-yl)piperidine-2-carboxylic acid

$$$$ Data

M. F.

C13H14N2O3

Suppliers	Catalog Number
Matrix Scientific	035875

Database	Data ID
PubChem	22617776

M. W.

246.26186

CAS

Similarity

N/A

ID: 33130

1-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperidine-4-carboxylic acid

$$$$ Data

M. F.

C12H13N3O3

Suppliers	Catalog Number
ChemBridge	3005024
Matrix Scientific	035876

Database	Data ID
PubChem	16767462

M. W.

247.24992

CAS

936074-71-4

Similarity

N/A

ID: 33131

[(1r,4r)-4-(5-methyl-1,3-benzoxazol-2-yl)cyclohexyl]methanamine

$$$$ Data

M. F.

C15H20N2O

Suppliers	Catalog Number
ChemBridge	3002744
Matrix Scientific	035877

Database	Data ID
PubChem	25219079

M. W.

244.3321

CAS

1217702-12-9

Similarity

N/A

ID: 33132

1-(5-tert-butyl-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid

$$$$ Data

M. F.

C17H22N2O3

Suppliers	Catalog Number
Matrix Scientific	035878

Database	Data ID
PubChem	25219080

M. W.

302.36818

CAS

Similarity

N/A

ID: 33133

1-(5-sulfamoyl-1,3-benzoxazol-2-yl)piperidine-4-carboxylic acid

$$$$ Data

M. F.

C13H15N3O5S

Suppliers	Catalog Number
Matrix Scientific	035879

Database	Data ID
PubChem	25219081

M. W.

325.3403

CAS

Similarity

N/A

ID: 33134

1-(5-chloro-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

$$$$ Data

M. F.

C13H13ClN2O3

Suppliers	Catalog Number
Matrix Scientific	035880

Database	Data ID
PubChem	25219082

M. W.

280.70692

CAS

Similarity

N/A

ID: 33135

3-(hydrazinecarbonyl)propanamide

$$$$ Data

M. F.

C4H9N3O2

Suppliers	Catalog Number
ChemBridge	3001572
Matrix Scientific	035881

Database	Data ID
PubChem	1416956

M. W.

131.13316

CAS

130673-36-8

Similarity

N/A

ID: 33136

1-{[1,3]oxazolo[4,5-b]pyridin-2-yl}piperidin-4-amine hydrochloride

$$$$ Data

M. F.

C11H15ClN4O

Suppliers	Catalog Number
Matrix Scientific	035882

Database	Data ID
PubChem	44118441

M. W.

254.716

CAS

Similarity

N/A

ID: 33137

1-(1,3-benzoxazol-2-yl)piperidin-4-amine hydrochloride

$$$$ Data

M. F.

C12H16ClN3O

Suppliers	Catalog Number
Matrix Scientific	035883

Database	Data ID
PubChem	21090379

M. W.

253.72794

CAS

Similarity

N/A

ID: 33138

[4-(5-chloro-1,3-benzoxazol-2-yl)morpholin-2-yl]methanamine hydrochloride

$$$$ Data

M. F.

C12H15Cl2N3O2

Suppliers	Catalog Number
Matrix Scientific	035884

Database	Data ID
PubChem	44120497

M. W.

304.1724

CAS

Similarity

N/A

ID: 33139

6-chloro-2-(1,4-diazepan-1-yl)-1,3-benzoxazole

$$$$ Data

M. F.

C12H14ClN3O

Suppliers	Catalog Number
Matrix Scientific	035885

Database	Data ID
PubChem	25219085

M. W.

251.71206

CAS

Similarity

N/A

ID: 33140

1-{5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}piperidin-4-amine hydrochloride

$$$$ Data

M. F.

C12H17ClN4O

Suppliers	Catalog Number
Matrix Scientific	035886

Database	Data ID
PubChem	44118442

M. W.

268.74258

CAS

Similarity

N/A

ID: 33141

1-(6-chloro-1,3-benzoxazol-2-yl)piperidin-4-amine hydrochloride

$$$$ Data

M. F.

C12H15Cl2N3O

Suppliers	Catalog Number
Matrix Scientific	035887

Database	Data ID
PubChem	44118443

M. W.

288.173

CAS

Similarity

N/A

ID: 33142

2-(piperazin-1-yl)-1,3-benzoxazole-5-sulfonamide

$$$$ Data

M. F.

C11H14N4O3S

Suppliers	Catalog Number
ChemBridge	3002882
Matrix Scientific	035888

Database	Data ID
PubChem	25219088

M. W.

282.31886

CAS

1035840-39-1

Similarity

N/A

ID: 33143

6-methyl-2-(piperidin-3-yl)-1,3-benzoxazole hydrochloride

$$$$ Data

M. F.

C13H17ClN2O

Suppliers	Catalog Number
Matrix Scientific	035889

Database	Data ID
PubChem	44118444

M. W.

252.73988

CAS

Similarity

N/A

ID: 33144

2-[1-(6-chloro-1,3-benzoxazol-2-yl)piperidin-3-yl]acetic acid

$$$$ Data

M. F.

C14H15ClN2O3

Suppliers	Catalog Number
Matrix Scientific	035890

Database	Data ID
PubChem	25219090

M. W.

294.7335

CAS

Similarity

N/A

ID: 33145

2-[1-(1,3-benzoxazol-2-yl)piperidin-3-yl]acetic acid

$$$$ Data

M. F.

C14H16N2O3

Suppliers	Catalog Number
Matrix Scientific	035891

Database	Data ID
PubChem	25219091

M. W.

260.28844

CAS

Similarity

N/A

ID: 33146

1-(1,3-benzoxazol-2-yl)piperidin-4-one

$$$$ Data

M. F.

C12H12N2O2

Suppliers	Catalog Number
ChemBridge	3002589
Matrix Scientific	035892

Database	Data ID
PubChem	25219092

M. W.

216.23588

CAS

1035840-42-6

Similarity

N/A

ID: 33147

(6-methyl-1,3-benzoxazol-2-yl)methanamine hydrochloride

$$$$ Data

M. F.

C9H11ClN2O

Suppliers	Catalog Number
Matrix Scientific	035893

Database	Data ID
PubChem	44118445

M. W.

198.64944

CAS

Similarity

N/A

ID: 33148

5-chloro-2-(piperazin-1-yl)-1,3-benzoxazole dihydrochloride

$$$$ Data

M. F.

C11H14Cl3N3O

Suppliers	Catalog Number
Matrix Scientific	035894

Database	Data ID
PubChem	44120498

M. W.

310.60736

CAS

Similarity

N/A

ID: 33149

6-chloro-2-(chloromethyl)-1,3-benzoxazole

$$$$ Data

M. F.

C8H5Cl2NO

Suppliers	Catalog Number
Matrix Scientific	035895
A&J Pharmtech	AJA-O21850

Database	Data ID
PubChem	16767389

M. W.

202.0374

CAS

202396-52-9

Similarity

N/A

ID: 33150

2-ethyl-1H-1,3-benzodiazole

$$$$ Data More

M. F.

C9H10N2

Suppliers	Catalog Number
ChemBridge	3001661
Matrix Scientific	035896
Enamine	EN300-16422

Database	Data ID
PubChem	15807

M. W.

146.1891

CAS

1848-84-6

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