Chembase list of 866358 unique molecular structures

1-(2,3-dimethyl-1H-indol-1-yl)-3-[(2-hydroxyethyl)amino]propan-2-ol; oxalic acid

$$$$ Data

M. F.

C17H24N2O6

Suppliers	Catalog Number
Matrix Scientific	008245

Database	Data ID
PubChem	16194145

M. W.

352.38226

CAS

Similarity

N/A

ID: 11302

1-(2,3-dimethyl-1H-indol-1-yl)-3-[(furan-2-ylmethyl)amino]propan-2-ol; oxalic ac...

$$$$ Data

M. F.

C20H24N2O6

Suppliers	Catalog Number
Matrix Scientific	008246

Database	Data ID
PubChem	2896382

M. W.

388.41436

CAS

Similarity

N/A

ID: 11303

3-[2-(benzylcarbamoyl)ethyl]-6-oxopiperidine-3-carboxylic acid

$$$$ Data

M. F.

C16H20N2O4

Suppliers	Catalog Number
Matrix Scientific	008248

Database	Data ID
PubChem	653992

M. W.

304.341

CAS

361372-43-2

Similarity

N/A

ID: 11304

ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate hydrochloride

$$$$ Data

M. F.

C12H16ClNO2

Suppliers	Catalog Number
Matrix Scientific	008250

Database	Data ID
PubChem	44890894

M. W.

241.71394

CAS

103733-33-1

Similarity

N/A

ID: 11305

2,1,3-benzoxadiazol-4-amine

$$$$ Data More

M. F.

C6H5N3O

Suppliers	Catalog Number
ChemBridge	3002710
Matrix Scientific	008251
Maybridge	BTB13048

Database	Data ID
PubChem	584570

M. W.

135.1234

CAS

767-63-5

Similarity

N/A

ID: 11306

4-(2-amino-1,3-thiazol-4-yl)-1-oxaspiro[4.5]decan-2-one

$$$$ Data

M. F.

C12H16N2O2S

Suppliers	Catalog Number
Matrix Scientific	008252

Database	Data ID
PubChem	581119

M. W.

252.33264

CAS

137180-65-5

Similarity

N/A

ID: 11307

7,7-dimethyl-2-oxo-1,8-dioxaspiro[4.5]decane-4-carboxylic acid

$$$$ Data

M. F.

C11H16O5

Suppliers	Catalog Number
Matrix Scientific	008253
InterBioScreen	STOCK1N-01751

Database	Data ID
PubChem	2836710

M. W.

228.24174

CAS

Similarity

N/A

ID: 11308

1-(4-ethoxybenzoyl)pyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C14H17NO4

Suppliers	Catalog Number
Matrix Scientific	008254
Apollo Scientific	OR14781

Database	Data ID
PubChem	590998

M. W.

263.28908

CAS

436811-16-4

Similarity

N/A

ID: 11309

1-[4-(2-methylpropoxy)benzoyl]pyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C16H21NO4

Suppliers	Catalog Number
Matrix Scientific	008255

Database	Data ID
PubChem	3143065

M. W.

291.34224

CAS

Similarity

N/A

ID: 11310

ethyl 3-(2-amino-1,3-thiazol-4-yl)-5-oxooxolane-3-carboxylate

$$$$ Data

M. F.

C10H12N2O4S

Suppliers	Catalog Number
Matrix Scientific	008256

Database	Data ID
PubChem	3143117

M. W.

256.27828

CAS

328275-97-4

Similarity

N/A

ID: 11311

5,7-dimethyl-3-{[(pyridin-3-ylmethyl)amino]methyl}-1,2-dihydroquinolin-2-one

$$$$ Data

M. F.

C18H19N3O

Suppliers	Catalog Number
Matrix Scientific	008257

Database	Data ID
PubChem	864583

M. W.

293.36296

CAS

Similarity

N/A

ID: 11312

4-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)formamido]butanoic acid

$$$$ Data

M. F.

C14H19NO4

Suppliers	Catalog Number
Matrix Scientific	008258

Database	Data ID
PubChem	595720

M. W.

265.30496

CAS

Similarity

N/A

ID: 11313

2-(2,3-dihydro-1,4-benzodioxin-6-ylformamido)acetic acid

$$$$ Data

M. F.

C11H11NO5

Suppliers	Catalog Number
Matrix Scientific	008259
Enamine	EN300-87037

Database	Data ID
PubChem	646722

M. W.

237.20874

CAS

Similarity

N/A

ID: 11314

2-(2,3-dihydro-1,4-benzodioxin-6-ylformamido)-4-methylpentanoic acid

$$$$ Data

M. F.

C15H19NO5

Suppliers	Catalog Number
Matrix Scientific	008260

Database	Data ID
PubChem	3143394

M. W.

293.31506

CAS

Similarity

N/A

ID: 11315

3-(2,3-dihydro-1,4-benzodioxin-6-ylformamido)propanoic acid

$$$$ Data

M. F.

C12H13NO5

Suppliers	Catalog Number
Matrix Scientific	008261

Database	Data ID
PubChem	3143396

M. W.

251.23532

CAS

Similarity

N/A

ID: 11316

4-(2,3-dihydro-1,4-benzodioxin-6-ylformamido)butanoic acid

$$$$ Data

M. F.

C13H15NO5

Suppliers	Catalog Number
Matrix Scientific	008262

Database	Data ID
PubChem	3143397

M. W.

265.2619

CAS

Similarity

N/A

ID: 11317

1-benzyl-5-oxopyrrolidine-3-carboxylic acid

$$$$ Data More

M. F.

C12H13NO3

Suppliers	Catalog Number
ChemBridge	3005223
Matrix Scientific	008263
Apollo Scientific	OR6330

Database	Data ID
PubChem	99024

M. W.

219.23652

CAS

2168-14-1

Similarity

N/A

ID: 11318

3,5-dimethyl-1H-pyrazol-4-amine

$$$$ Data More

M. F.

C5H9N3

Suppliers	Catalog Number
ChemBridge	4029772
Matrix Scientific	008264
InterBioScreen	BB_SC-5938

Database	Data ID
PubChem	78931

M. W.

111.14506

CAS

5272-86-6

Similarity

N/A

ID: 11319

2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

$$$$ Data

M. F.

C11H10N2O3

Suppliers	Catalog Number
Matrix Scientific	008265
InterBioScreen	BB_SC-10392
Enamine	EN300-12980

Database	Data ID
PubChem	706524

M. W.

218.2087

CAS

28081-52-9

Similarity

N/A

ID: 11320

2-(3-butyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetic acid

$$$$ Data

M. F.

C14H16N2O3

Suppliers	Catalog Number
Matrix Scientific	008266

Database	Data ID
PubChem	2063840

M. W.

260.28844

CAS

Similarity

N/A

ID: 11321

2-[(2,5-dimethylfuran-3-yl)formamido]-3-phenylpropanoic acid

$$$$ Data

M. F.

C16H17NO4

Suppliers	Catalog Number
Matrix Scientific	008267

Database	Data ID
PubChem	2896685

M. W.

287.31048

CAS

Similarity

N/A

ID: 11322

1-(2,6-dimethoxybenzoyl)piperazine; trifluoroacetic acid

$$$$ Data

M. F.

C15H19F3N2O5

Suppliers	Catalog Number
Matrix Scientific	008268

Database	Data ID
PubChem	45074755

M. W.

364.3169696

CAS

Similarity

N/A

ID: 11323

1-{5-amino-2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-y...

$$$$ Data

M. F.

C18H21N3O

Suppliers	Catalog Number
Matrix Scientific	008269

Database	Data ID
PubChem	2834210

M. W.

295.37884

CAS

Similarity

N/A

ID: 11324

5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol

$$$$ Data

M. F.

C9H10N4S

Suppliers	Catalog Number
Matrix Scientific	008270

Database	Data ID
PubChem	801777

M. W.

206.2675

CAS

149622-77-5

Similarity

N/A

ID: 11325

1-(3,4-dimethylbenzenesulfonyl)cyclopentane-1-carboxylic acid

$$$$ Data

M. F.

C14H18O4S

Suppliers	Catalog Number
Matrix Scientific	008271
Enamine	EN300-24422

Database	Data ID
PubChem	645807

M. W.

282.35532

CAS

Similarity

N/A

ID: 11326

1-(4-chlorobenzenesulfonyl)cyclopentane-1-carboxylic acid

$$$$ Data

M. F.

C12H13ClO4S

Suppliers	Catalog Number
Matrix Scientific	008272
Enamine	EN300-24283

Database	Data ID
PubChem	763196

M. W.

288.74722

CAS

Similarity

N/A

ID: 11327

4-(pyrrolidin-1-yl)benzaldehyde

$$$$ Data More

M. F.

C11H13NO

Suppliers	Catalog Number
Sigma Aldrich	678821
Alfa Aesar	L00966
Matrix Scientific	008273

Database	Data ID
PubChem	104037

M. W.

175.22702

CAS

51980-54-2

Similarity

N/A

ID: 11328

2-(5-formylfuran-2-yl)benzoic acid

$$$$ Data

M. F.

C12H8O4

Suppliers	Catalog Number
Matrix Scientific	008274
InterBioScreen	BB_SC-0572

Database	Data ID
PubChem	2771930

M. W.

216.18952

CAS

Similarity

N/A

ID: 11329

methyl 2-(3-formyl-1H-indol-1-yl)acetate

$$$$ Data

M. F.

C12H11NO3

Suppliers	Catalog Number
ChemBridge	4002637
Matrix Scientific	008275
InterBioScreen	BB_NC-2362

Database	Data ID
PubChem	771477

M. W.

217.22064

CAS

351015-73-1

Similarity

N/A

ID: 11330

2-methanesulfonamidobenzoic acid

$$$$ Data

M. F.

C8H9NO4S

Suppliers	Catalog Number
Matrix Scientific	008276
InterBioScreen	BB_SC-8399
Enamine	EN300-10272

Database	Data ID
PubChem	786039

M. W.

215.22636

CAS

162787-61-3

Similarity

N/A

ID: 11331

2-[5-oxo-1-(prop-2-en-1-yl)-2-sulfanylideneimidazolidin-4-yl]acetic acid

$$$$ Data

M. F.

C8H10N2O3S

Suppliers	Catalog Number
ChemBridge	6566782
Matrix Scientific	008277

Database	Data ID
PubChem	3144196

M. W.

214.2416

CAS

55523-05-2

Similarity

N/A

ID: 11332

3-[5-oxo-1-(prop-2-en-1-yl)-2-sulfanylideneimidazolidin-4-yl]propanoic acid

$$$$ Data

M. F.

C9H12N2O3S

Suppliers	Catalog Number
ChemBridge	6538728
Matrix Scientific	008278

Database	Data ID
PubChem	3144199

M. W.

228.26818

CAS

436855-68-4

Similarity

N/A

ID: 11333

(3,5-dihydro-1H-2,4-benzodioxepin-3-ylmethyl)(furan-2-ylmethyl)amine hydrochlori...

$$$$ Data

M. F.

C15H18ClNO3

Suppliers	Catalog Number
Matrix Scientific	008279

Database	Data ID
PubChem	45074756

M. W.

295.76132

CAS

Similarity

N/A

ID: 11334

(3,5-dihydro-1H-2,4-benzodioxepin-3-ylmethyl)(2-methylpropyl)amine hydrochloride

$$$$ Data

M. F.

C14H22ClNO2

Suppliers	Catalog Number
Matrix Scientific	008280

Database	Data ID
PubChem	16192657

M. W.

271.78298

CAS

Similarity

N/A

ID: 11335

1,5-dimethyl-1H-pyrazole-4-carbaldehyde

$$$$ Data More

M. F.

C6H8N2O

Suppliers	Catalog Number
ChemBridge	4300330
Matrix Scientific	008281
InterBioScreen	BB_SC-3693

Database	Data ID
PubChem	579643

M. W.

124.14052

CAS

25711-30-2

Similarity

N/A

ID: 11336

5-amino-1-(propan-2-yl)-1H-pyrazol-3-ol

$$$$ Data

M. F.

C6H11N3O

Suppliers	Catalog Number
Matrix Scientific	008282
InterBioScreen	BB_SC-1584

Database	Data ID
PubChem	801260

M. W.

141.17104

CAS

78317-68-7

Similarity

N/A

ID: 11337

5-amino-1-(butan-2-yl)-1H-pyrazol-3-ol

$$$$ Data

M. F.

C7H13N3O

Suppliers	Catalog Number
Matrix Scientific	008283
InterBioScreen	BB_SC-1586

Database	Data ID
PubChem	649343

M. W.

155.19762

CAS

436088-85-6

Similarity

N/A

ID: 11338

5-amino-1-cyclopentyl-1H-pyrazol-3-ol

$$$$ Data

M. F.

C8H13N3O

Suppliers	Catalog Number
Matrix Scientific	008284

Database	Data ID
PubChem	801265

M. W.

167.20832

CAS

436088-87-8

Similarity

N/A

ID: 11339

5-amino-1-cyclohexyl-1H-pyrazol-3-ol

$$$$ Data

M. F.

C9H15N3O

Suppliers	Catalog Number
ChemBridge	4026988
Matrix Scientific	008285

Database	Data ID
PubChem	740823

M. W.

181.2349

CAS

436088-86-7

Similarity

N/A

ID: 11340

N-methyl-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide

$$$$ Data

M. F.

C11H13N3O2

Suppliers	Catalog Number
Matrix Scientific	008286

Database	Data ID
PubChem	3144292

M. W.

219.23982

CAS

Similarity

N/A

ID: 11341

1-{2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl}-2-chl...

$$$$ Data

M. F.

C16H14ClNO

Suppliers	Catalog Number
Matrix Scientific	008287
Enamine	EN300-27671

Database	Data ID
PubChem	606505

M. W.

271.74146

CAS

3534-05-2

Similarity

N/A

ID: 11342

2-chloro-1-(10H-phenothiazin-10-yl)propan-1-one

$$$$ Data

M. F.

C15H12ClNOS

Suppliers	Catalog Number
Matrix Scientific	008288
Apollo Scientific	OR27741
Enamine	EN300-18378

Database	Data ID
PubChem	352185

M. W.

289.77988

CAS

38076-63-0

Similarity

N/A

ID: 11343

4-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-3,3-dimethylbutanoic acid

$$$$ Data

M. F.

C14H17NO5

Suppliers	Catalog Number
Matrix Scientific	008291

Database	Data ID
PubChem	739850

M. W.

279.28848

CAS

436088-57-2

Similarity

N/A

ID: 11344

N-[3-(benzylamino)propyl]pyridine-3-carboxamide hydrochloride

$$$$ Data

M. F.

C16H20ClN3O

Suppliers	Catalog Number
Matrix Scientific	008292

Database	Data ID
PubChem	6456575

M. W.

305.8025

CAS

Similarity

N/A

ID: 11345

N-[3-(benzylamino)propyl]pyridine-4-carboxamide

$$$$ Data

M. F.

C16H19N3O

Suppliers	Catalog Number
Matrix Scientific	008293

Database	Data ID
PubChem	562126

M. W.

269.34156

CAS

Similarity

N/A

ID: 11346

N-(3-{[3-(dimethylamino)propyl]amino}propyl)pyridine-4-carboxamide

$$$$ Data

M. F.

C14H24N4O

Suppliers	Catalog Number
Matrix Scientific	008294

Database	Data ID
PubChem	654514

M. W.

264.36656

CAS

Similarity

N/A

ID: 11347

N-(3-{[3-(dimethylamino)propyl]amino}propyl)pyridine-3-carboxamide

$$$$ Data

M. F.

C14H24N4O

Suppliers	Catalog Number
Matrix Scientific	008295

Database	Data ID
PubChem	1595813

M. W.

264.36656

CAS

404013-89-4

Similarity

N/A

ID: 11348

4-amino-2-(furan-2-amido)benzoic acid

$$$$ Data

M. F.

C12H10N2O4

Suppliers	Catalog Number
Matrix Scientific	008296

Database	Data ID
PubChem	800418

M. W.

246.2188

CAS

462068-49-1

Similarity

N/A

ID: 11349

(2-{[(4-fluorophenyl)amino]methyl}phenyl)methanol hydrochloride

$$$$ Data

M. F.

C14H15ClFNO

Suppliers	Catalog Number
Matrix Scientific	008297

Database	Data ID
PubChem	16641243

M. W.

267.7264032

CAS

Similarity

N/A

ID: 11350

(2-{[(2,5-dimethylphenyl)amino]methyl}phenyl)methanol

$$$$ Data

M. F.

C16H19NO

Suppliers	Catalog Number
Matrix Scientific	008298

Database	Data ID
PubChem	687023

M. W.

241.32816

CAS

356538-93-7

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