Chembase list of 866358 unique molecular structures

3,5-dimethyl-1H-pyrazole-4-carboxylic acid

$$$$ Data More

M. F.

C6H8N2O2

Suppliers	Catalog Number
Matrix Scientific	035796
Key Organics	10X-0856
Maybridge	CC01201

Database	Data ID
PubChem	2776164

M. W.

140.13992

CAS

113808-86-9

Similarity

N/A

ID: 33052

1-[(4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid

$$$$ Data More

M. F.

C13H15NO4

Suppliers	Catalog Number
Matrix Scientific	035797
Apollo Scientific	OR2611
InterBioScreen	BB_SC-10976

Database	Data ID
PubChem	2959610

M. W.

249.2625

CAS

Similarity

N/A

ID: 33053

2-ethyl-1,3-thiazole-4-carboxylic acid

$$$$ Data

M. F.

C6H7NO2S

Suppliers	Catalog Number
Matrix Scientific	035798

Database	Data ID
PubChem	25218855

M. W.

157.19028

CAS

769124-05-2

Similarity

N/A

ID: 33054

2-(propan-2-yl)-1,3-thiazole-4-carboxylic acid

$$$$ Data More

M. F.

C7H9NO2S

Suppliers	Catalog Number
ChemBridge	4003979
Matrix Scientific	035799
Enamine	EN300-64622

Database	Data ID
PubChem	22573065

M. W.

171.21686

CAS

234445-61-5

Similarity

N/A

ID: 33055

5-methoxy-1H-indole-2-carboxylic acid

$$$$ Data More

M. F.

C10H9NO3

Suppliers	Catalog Number
Sigma Aldrich	M14951
ChemBridge	3020286
MP Biomedicals	02102302

Database	Data ID
PubChem	20401

M. W.

191.18336

CAS

4382-54-1

Similarity

N/A

ID: 33056

3-(pyridin-2-yl)propanoic acid hydrochloride

$$$$ Data

M. F.

C8H10ClNO2

Suppliers	Catalog Number
Matrix Scientific	035801

Database	Data ID
PubChem	44118481

M. W.

187.6235

CAS

Similarity

N/A

ID: 33057

2-hydrazinyl-1H-1,3-benzodiazole

$$$$ Data More

M. F.

C7H8N4

Suppliers	Catalog Number
ChemBridge	4100063
Matrix Scientific	035802
Key Organics	3Y-0941

Database	Data ID
PubChem	95788

M. W.

148.16522

CAS

15108-18-6

Similarity

N/A

ID: 33058

(1,3-dimethyl-1H-pyrazol-4-yl)methanamine

$$$$ Data

M. F.

C6H11N3

Suppliers	Catalog Number
ChemBridge	4100323
Matrix Scientific	035803
A&J Pharmtech	AJA-O14200

Database	Data ID
PubChem	1257622

M. W.

125.17164

CAS

400756-28-7

Similarity

N/A

ID: 33059

3-(1H-indazol-1-yl)propan-1-amine

$$$$ Data

M. F.

C10H13N3

Suppliers	Catalog Number
ChemBridge	4006223
Matrix Scientific	035804

Database	Data ID
PubChem	11959109

M. W.

175.23032

CAS

933744-08-2

Similarity

N/A

ID: 33060

2-(piperidin-2-yl)-1,3-benzoxazole

$$$$ Data

M. F.

C12H14N2O

Suppliers	Catalog Number
Matrix Scientific	035805

Database	Data ID
PubChem	4961930

M. W.

202.25236

CAS

Similarity

N/A

ID: 33061

2-(2H-indazol-2-yl)acetic acid

$$$$ Data More

M. F.

C9H8N2O2

Suppliers	Catalog Number
ChemBridge	4006215
Matrix Scientific	035806
Enamine	EN300-71681

Database	Data ID
PubChem	12252435

M. W.

176.17202

CAS

58037-05-1

Similarity

N/A

ID: 33062

2-(1H-indazol-1-yl)acetic acid

$$$$ Data More

M. F.

C9H8N2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00028
ChemBridge	4402492
Matrix Scientific	035807

Database	Data ID
PubChem	6422830

M. W.

176.17202

CAS

32829-25-7

Similarity

N/A

ID: 33063

3-isothiocyanatobenzoic acid

$$$$ Data

M. F.

C8H5NO2S

Suppliers	Catalog Number
Alfa Aesar	L11322
Matrix Scientific	035808

Database	Data ID
PubChem	75046

M. W.

179.1958

CAS

2131-63-7

Similarity

N/A

ID: 33064

1-(diethylamino)cyclohexane-1-carboxylic acid

$$$$ Data

M. F.

C11H21NO2

Suppliers	Catalog Number
Matrix Scientific	035809

Database	Data ID
PubChem	24206575

M. W.

199.28994

CAS

Similarity

N/A

ID: 33065

1-(piperidin-1-yl)propan-2-one

$$$$ Data

M. F.

C8H15NO

Suppliers	Catalog Number
ChemBridge	4028176
Matrix Scientific	035810

Database	Data ID
PubChem	81243

M. W.

141.2108

CAS

6784-61-8

Similarity

N/A

ID: 33066

1-(morpholin-4-yl)propan-2-one

$$$$ Data

M. F.

C7H13NO2

Suppliers	Catalog Number
ChemBridge	4027871
Matrix Scientific	035811
A&J Pharmtech	AJA-O23505

Database	Data ID
PubChem	11029948

M. W.

143.18362

CAS

6704-35-4

Similarity

N/A

ID: 33067

1-(1H-imidazol-1-yl)propan-2-one hydrochloride

$$$$ Data

M. F.

C6H9ClN2O

Suppliers	Catalog Number
Matrix Scientific	035812

Database	Data ID
PubChem	44118523

M. W.

160.60146

CAS

Similarity

N/A

ID: 33068

(dimethyl-1,2-oxazol-4-yl)methanamine hydrochloride

$$$$ Data

M. F.

C6H11ClN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR01039
Matrix Scientific	035813
InterBioScreen	BB_SC-9067

Database	Data ID
PubChem	45782704

M. W.

162.61734

CAS

131052-47-6

Similarity

N/A

ID: 33069

[(dimethyl-1,2-oxazol-4-yl)methyl](methyl)amine

$$$$ Data

M. F.

C7H12N2O

Suppliers	Catalog Number
ChemBridge	4100666
Matrix Scientific	035814
Enamine	EN300-36062

Database	Data ID
PubChem	23006353

M. W.

140.18298

CAS

893641-32-2

Similarity

N/A

ID: 33070

2-oxo-1,2,3,4-tetrahydroquinoline-6-carboxylic acid

$$$$ Data

M. F.

C10H9NO3

Suppliers	Catalog Number
Matrix Scientific	035815
Enamine	EN300-23517
Bide Pharmatech	BD34696

Database	Data ID
PubChem	7131909

M. W.

191.18336

CAS

70639-77-9

Similarity

N/A

ID: 33071

2-(5-phenyl-4H-1,2,4-triazol-3-yl)acetic acid

$$$$ Data

M. F.

C10H9N3O2

Suppliers	Catalog Number
ChemBridge	4401159
Matrix Scientific	035816
A&J Pharmtech	AJA-O30536 AJA-O14246

Database	Data ID
PubChem	17609309

M. W.

203.19736

CAS

328084-14-6

Similarity

N/A

ID: 33072

2-(phenylamino)acetic acid

$$$$ Data More

M. F.

C8H9NO2

Suppliers	Catalog Number
Sigma Aldrich	330469 78560
MP Biomedicals	02151835 05216564
Alfa Aesar	A14182

Database	Data ID
PubChem	66025

M. W.

151.16256

CAS

103-01-5

Similarity

N/A

ID: 33073

1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid

$$$$ Data More

M. F.

C12H12FNO3

Suppliers	Catalog Number
ChemBridge	3005242
Matrix Scientific	035818
Maybridge	MO00127

Database	Data ID
PubChem	2780702

M. W.

237.2269832

CAS

96449-68-2

Similarity

N/A

ID: 33074

(2E)-3-(1-methyl-1H-pyrazol-4-yl)prop-2-enoic acid

$$$$ Data

M. F.

C7H8N2O2

Suppliers	Catalog Number
ChemBridge	4001627
Matrix Scientific	035819
Enamine	EN300-22549

Database	Data ID
PubChem	1529858

M. W.

152.15062

CAS

689251-97-6

Similarity

N/A

ID: 33075

tert-butyl N-(piperidin-4-yl)carbamate

$$$$ Data More

M. F.

C10H20N2O2

Suppliers	Catalog Number
Sigma Aldrich	540935
Alfa Aesar	H28517
Matrix Scientific	035820

Database	Data ID
PubChem	723833

M. W.

200.278

CAS

73874-95-0

Similarity

N/A

ID: 33076

2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetic acid

$$$$ Data More

M. F.

C10H7NO4

Suppliers	Catalog Number
Sigma Aldrich	P40506 79850
ChemBridge	3002657
Alfa Aesar	A15920

Database	Data ID
PubChem	20825

M. W.

205.16688

CAS

4702-13-0

Similarity

N/A

ID: 33077

3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoic acid

$$$$ Data More

M. F.

C11H9NO4

Suppliers	Catalog Number
ChemBridge	3005053
Alfa Aesar	L13535
Matrix Scientific	035822

Database	Data ID
PubChem	76859

M. W.

219.19346

CAS

3339-73-9

Similarity

N/A

ID: 33078

3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoic acid

$$$$ Data More

M. F.

C11H10N2O3

Suppliers	Catalog Number
Sigma Aldrich	CBR00353
ChemBridge	4002239
Matrix Scientific	035823

Database	Data ID
PubChem	665968

M. W.

218.2087

CAS

24088-59-3

Similarity

N/A

ID: 33079

5-(phenoxymethyl)furan-2-carboxylic acid

$$$$ Data

M. F.

C12H10O4

Suppliers	Catalog Number
Matrix Scientific	035824
InterBioScreen	BB_SC-5950
Enamine	EN300-10263

Database	Data ID
PubChem	580491

M. W.

218.2054

CAS

91368-74-0

Similarity

N/A

ID: 33080

N-cyclopropylcyclohexanamine hydrochloride

$$$$ Data

M. F.

C9H18ClN

Suppliers	Catalog Number
Matrix Scientific	035825
Enamine	EN300-53389

Database	Data ID
PubChem	44118464

M. W.

175.69892

CAS

Similarity

N/A

ID: 33081

(2-methoxyethyl)(oxolan-2-ylmethyl)amine

$$$$ Data

M. F.

C8H17NO2

Suppliers	Catalog Number
ChemBridge	4015168
Matrix Scientific	035826

Database	Data ID
PubChem	25218868

M. W.

159.22608

CAS

55100-02-2

Similarity

N/A

ID: 33082

2-(1,4-diazepan-1-yl)-1,3-benzothiazole; trifluoroacetic acid

$$$$ Data

M. F.

C14H16F3N3O2S

Suppliers	Catalog Number
Matrix Scientific	035827

Database	Data ID
PubChem	46736895

M. W.

347.3559496

CAS

Similarity

N/A

ID: 33083

1-(2-ethoxyphenyl)ethan-1-amine

$$$$ Data

M. F.

C10H15NO

Suppliers	Catalog Number
ChemBridge	4028696
Matrix Scientific	035828
Enamine	EN300-33181

Database	Data ID
PubChem	4019232

M. W.

165.2322

CAS

603945-49-9

Similarity

N/A

ID: 33084

2-(azidomethyl)-5-chloro-1,3-benzoxazole

$$$$ Data

M. F.

C8H5ClN4O

Suppliers	Catalog Number
Matrix Scientific	035830

Database	Data ID
PubChem	25219051

M. W.

208.6045

CAS

Similarity

N/A

ID: 33085

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

$$$$ Data

M. F.

C8H5ClN4O

Suppliers	Catalog Number
Matrix Scientific	035831

Database	Data ID
PubChem	25219052

M. W.

208.6045

CAS

Similarity

N/A

ID: 33086

1-[ethyl(methyl)amino]propan-2-one hydrochloride

$$$$ Data

M. F.

C6H14ClNO

Suppliers	Catalog Number
Matrix Scientific	035832

Database	Data ID
PubChem	44118520

M. W.

151.63446

CAS

Similarity

N/A

ID: 33087

1-(azepan-1-yl)propan-2-one hydrochloride

$$$$ Data

M. F.

C9H18ClNO

Suppliers	Catalog Number
Matrix Scientific	035833

Database	Data ID
PubChem	44118521

M. W.

191.69832

CAS

Similarity

N/A

ID: 33088

1-(4-methylpiperazin-1-yl)propan-2-one

$$$$ Data

M. F.

C8H16N2O

Suppliers	Catalog Number
ChemBridge	4027592
Matrix Scientific	035834
A&J Pharmtech	AJA-O20895

Database	Data ID
PubChem	10534927

M. W.

156.22544

CAS

15885-04-8

Similarity

N/A

ID: 33089

1-(3-methylpiperidin-1-yl)propan-2-one

$$$$ Data

M. F.

C9H17NO

Suppliers	Catalog Number
ChemBridge	4026786
Matrix Scientific	035835

Database	Data ID
PubChem	25219054

M. W.

155.23738

CAS

856286-98-1

Similarity

N/A

ID: 33090

1-(2-methylpiperidin-1-yl)propan-2-one

$$$$ Data

M. F.

C9H17NO

Suppliers	Catalog Number
ChemBridge	4028609
Matrix Scientific	035836

Database	Data ID
PubChem	3553102

M. W.

155.23738

CAS

24633-45-2

Similarity

N/A

ID: 33091

N-(2-aminoethyl)propanamide

$$$$ Data

M. F.

C5H12N2O

Suppliers	Catalog Number
ChemBridge	4028425
Matrix Scientific	035837

Database	Data ID
PubChem	4551317

M. W.

116.16158

CAS

925-58-6

Similarity

N/A

ID: 33092

ethyl 4-chlorobutanecarboximidate hydrochloride

$$$$ Data

M. F.

C6H13Cl2NO

Suppliers	Catalog Number
Matrix Scientific	035838

Database	Data ID
PubChem	13163359

M. W.

186.07952

CAS

Similarity

N/A

ID: 33093

ethyl 3-chloropropanecarboximidate hydrochloride

$$$$ Data

M. F.

C5H11Cl2NO

Suppliers	Catalog Number
Matrix Scientific	035839

Database	Data ID
PubChem	12494904

M. W.

172.05294

CAS

Similarity

N/A

ID: 33094

2-(1,4-diazepan-1-yl)-1,3-benzoxazole; trifluoroacetic acid

$$$$ Data

M. F.

C14H16F3N3O3

Suppliers	Catalog Number
Matrix Scientific	035840

Database	Data ID
PubChem	46736896

M. W.

331.2903496

CAS

Similarity

N/A

ID: 33095

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

$$$$ Data

M. F.

C13H16N2O

Suppliers	Catalog Number
Matrix Scientific	035841

Database	Data ID
PubChem	22028512

M. W.

216.27894

CAS

Similarity

N/A

ID: 33096

[1-(1,3-benzoxazol-2-yl)pyrrolidin-3-yl]methanamine hydrochloride

$$$$ Data

M. F.

C12H16ClN3O

Suppliers	Catalog Number
Matrix Scientific	035842

Database	Data ID
PubChem	44118425

M. W.

253.72794

CAS

Similarity

N/A

ID: 33097

tert-butyl N-(morpholin-2-ylmethyl)carbamate

$$$$ Data

M. F.

C10H20N2O3

Suppliers	Catalog Number
ChemBridge	4036819
Matrix Scientific	035843
Maybridge	MO08372

Database	Data ID
PubChem	19081107

M. W.

216.2774

CAS

173341-02-1

Similarity

N/A

ID: 33098

tert-butyl N-[2-(morpholin-2-yl)ethyl]carbamate

$$$$ Data

M. F.

C11H22N2O3

Suppliers	Catalog Number
ChemBridge	4036712
Matrix Scientific	035844

Database	Data ID
PubChem	25219056

M. W.

230.30398

CAS

1032507-63-3

Similarity

N/A

ID: 33099

[(6-fluoro-1H-1,3-benzodiazol-2-yl)methyl](methyl)amine dihydrochloride

$$$$ Data

M. F.

C9H12Cl2FN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00623
Matrix Scientific	035845

Database	Data ID
PubChem	44118433

M. W.

252.1160832

CAS

Similarity

N/A

ID: 33100

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

$$$$ Data

M. F.

C9H11ClN2O

Suppliers	Catalog Number
Matrix Scientific	035846

Database	Data ID
PubChem	44118434

M. W.

198.64944

CAS

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