Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C7H4Cl3NS

Suppliers	Catalog Number
Matrix Scientific	057194

Database	Data ID
PubChem	45040729

M. W.

240.53736

CAS

Similarity

N/A

ID: 52552

({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)carbonitrile

$$$$ Data

M. F.

C9H6F3NS

Suppliers	Catalog Number
Matrix Scientific	057197

Database	Data ID
PubChem	45040730

M. W.

217.2108496

CAS

Similarity

N/A

ID: 52553

({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)carbonitrile

$$$$ Data

M. F.

C9H6F3NS

Suppliers	Catalog Number
Matrix Scientific	057198

Database	Data ID
PubChem	13975636

M. W.

217.2108496

CAS

Similarity

N/A

ID: 52554

({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)carbonitrile

$$$$ Data

M. F.

C9H6F3NS

Suppliers	Catalog Number
Matrix Scientific	057199

Database	Data ID
PubChem	39388437

M. W.

217.2108496

CAS

Similarity

N/A

ID: 52555

3-[4-(trifluoromethyl)phenyl]propanoic acid

$$$$ Data More

M. F.

C10H9F3O2

Suppliers	Catalog Number
Sigma Aldrich	457035
Alfa Aesar	H54010
Matrix Scientific	057201

Database	Data ID
PubChem	3588736

M. W.

218.1724696

CAS

53473-36-2

Similarity

N/A

ID: 52556

(2,4,6-trifluorophenyl)thiourea

$$$$ Data

M. F.

C7H5F3N2S

Suppliers	Catalog Number
Matrix Scientific	057202

Database	Data ID
PubChem	56832300

M. W.

206.1882096

CAS

Similarity

N/A

ID: 52557

3,4,5-trihydroxybenzohydrazide

$$$$ Data

M. F.

C7H8N2O4

Suppliers	Catalog Number
Matrix Scientific	057203

Database	Data ID
PubChem	592744

M. W.

184.14942

CAS

5782-85-4

Similarity

N/A

ID: 52558

3,4,5-trimethoxybenzohydrazide

$$$$ Data More

M. F.

C10H14N2O4

Suppliers	Catalog Number
ChemBridge	4045167
MP Biomedicals	05219444
Alfa Aesar	B20055

Database	Data ID
PubChem	76793

M. W.

226.22916

CAS

3291-03-0

Similarity

N/A

ID: 52559

(2,3,4-trimethoxyphenyl)methanol

$$$$ Data More

M. F.

C10H14O4

Suppliers	Catalog Number
Sigma Aldrich	195863
Matrix Scientific	057205
TRC	T795690

Database	Data ID
PubChem	123571

M. W.

198.21576

CAS

71989-96-3

Similarity

N/A

ID: 52560

(2,4,6-trimethoxyphenyl)methanol

$$$$ Data

M. F.

C10H14O4

Suppliers	Catalog Number
Alfa Aesar	H50348
Matrix Scientific	057206
Enamine	EN300-110480

Database	Data ID
PubChem	602515

M. W.

198.21576

CAS

3840-31-1

Similarity

N/A

ID: 52561

2-(2,4,5-trimethylphenyl)acetonitrile

$$$$ Data

M. F.

C11H13N

Suppliers	Catalog Number
Matrix Scientific	057207

Database	Data ID
PubChem	144727

M. W.

159.22762

CAS

75279-58-2

Similarity

N/A

ID: 52562

2-(2,4,6-trimethylphenyl)acetonitrile

$$$$ Data More

M. F.

C11H13N

Suppliers	Catalog Number
Sigma Aldrich	554308
MP Biomedicals	05221580
Alfa Aesar	B20534

Database	Data ID
PubChem	520698

M. W.

159.22762

CAS

34688-71-6

Similarity

N/A

ID: 52563

(2,4,6-trimethylphenyl)thiourea

$$$$ Data

M. F.

C10H14N2S

Suppliers	Catalog Number
Alfa Aesar	A12083
Matrix Scientific	057209
Apollo Scientific	OR28421

Database	Data ID
PubChem	2731118

M. W.

194.29656

CAS

91059-97-1

Similarity

N/A

ID: 52564

trimethylsulfanium iodide

$$$$ Data More

M. F.

C3H9IS

Suppliers	Catalog Number
Sigma Aldrich	T80489 92762
Alfa Aesar	A12639
Matrix Scientific	057210

Database	Data ID
PubChem	75127

M. W.

204.07303

CAS

2181-42-2

Similarity

N/A

ID: 52565

(isothiocyanatodiphenylmethyl)benzene

$$$$ Data

M. F.

C20H15NS

Suppliers	Catalog Number
Sigma Aldrich	591904
Alfa Aesar	L08357
Matrix Scientific	057211

Database	Data ID
PubChem	137175

M. W.

301.4048

CAS

1726-94-9

Similarity

N/A

ID: 52566

3-amino-1-(triphenylmethyl)thiourea

$$$$ Data

M. F.

C20H19N3S

Suppliers	Catalog Number
Matrix Scientific	057212

Database	Data ID
PubChem	2760888

M. W.

333.44996

CAS

21198-26-5

Similarity

N/A

ID: 52567

2-phenylbut-3-enenitrile

$$$$ Data

M. F.

C10H9N

Suppliers	Catalog Number
Matrix Scientific	057213

Database	Data ID
PubChem	14767509

M. W.

143.18516

CAS

Similarity

N/A

ID: 52568

(2R)-2-methyl-1-[(1S)-1-phenylethyl]piperidin-4-one

$$$$ Data

M. F.

C14H19NO

Suppliers	Catalog Number
Matrix Scientific	057218

Database	Data ID
PubChem	13198302

M. W.

217.30676

CAS

103539-61-3

Similarity

N/A

ID: 52569

(2S)-2-methyl-1-[(1S)-1-phenylethyl]piperidin-4-one

$$$$ Data

M. F.

C14H19NO

Suppliers	Catalog Number
Matrix Scientific	057219

Database	Data ID
PubChem	13198301

M. W.

217.30676

CAS

103539-60-2

Similarity

N/A

ID: 52570

9H-fluoren-9-ylmethyl 3-oxopiperidine-1-carboxylate

$$$$ Data More

M. F.

C20H19NO3

Suppliers	Catalog Number
Sigma Aldrich	706639
Alfa Aesar	H58735
Matrix Scientific	057220

Database	Data ID
PubChem	1514170

M. W.

321.36976

CAS

672310-11-1

Similarity

N/A

ID: 52571

9H-fluoren-9-ylmethyl 3-hydroxypiperidine-1-carboxylate

$$$$ Data

M. F.

C20H21NO3

Suppliers	Catalog Number
Matrix Scientific	057221

Database	Data ID
PubChem	46835692

M. W.

323.38564

CAS

1072502-05-6

Similarity

N/A

ID: 52572

4-hydroxy-4-(nitromethyl)cyclohexan-1-one

$$$$ Data

M. F.

C7H11NO4

Suppliers	Catalog Number
Matrix Scientific	057222

Database	Data ID
PubChem	13201975

M. W.

173.16654

CAS

87875-48-7

Similarity

N/A

ID: 52573

8-(nitromethyl)-1,4-dioxaspiro[4.5]decan-8-ol

$$$$ Data

M. F.

C9H15NO5

Suppliers	Catalog Number
Matrix Scientific	057223

Database	Data ID
PubChem	46835693

M. W.

217.2191

CAS

879514-21-3

Similarity

N/A

ID: 52574

ethyl 3H-spiro[2-benzofuran-1,4'-piperidine]-1'-carboxylate

$$$$ Data

M. F.

C15H19NO3

Suppliers	Catalog Number
Matrix Scientific	057224

Database	Data ID
PubChem	10539335

M. W.

261.31626

CAS

42191-83-3

Similarity

N/A

ID: 52575

(2S)-1-[(tert-butoxy)carbonyl]-4-oxopiperidine-2-carboxylic acid

$$$$ Data More

M. F.

C11H17NO5

Suppliers	Catalog Number
Sigma Aldrich	676322
Alfa Aesar	H57617
Matrix Scientific	057226

Database	Data ID
PubChem	10857681

M. W.

243.25638

CAS

198646-60-5

Similarity

N/A

ID: 52576

2-benzyl-1-chloropiperidine

$$$$ Data

M. F.

C12H16ClN

Suppliers	Catalog Number
Matrix Scientific	057227

Database	Data ID
PubChem	49757935

M. W.

209.71514

CAS

Similarity

N/A

ID: 52577

ethyl 4-hydroxy-4-[2-(hydroxymethyl)phenyl]piperidine-1-carboxylate

$$$$ Data

M. F.

C15H21NO4

Suppliers	Catalog Number
Matrix Scientific	057228

Database	Data ID
PubChem	10802629

M. W.

279.33154

CAS

71546-51-5

Similarity

N/A

ID: 52578

tert-butyl 4-[2-(methylamino)ethyl]piperidine-1-carboxylate

$$$$ Data

M. F.

C13H26N2O2

Suppliers	Catalog Number
Matrix Scientific	057229

Database	Data ID
PubChem	46835695

M. W.

242.35774

CAS

896103-62-1

Similarity

N/A

ID: 52579

tert-butyl 3,3-dimethyl-4-oxopiperidine-1-carboxylate

$$$$ Data

M. F.

C12H21NO3

Suppliers	Catalog Number
Matrix Scientific	057230
Bide Pharmatech	BD51862
A&J Pharmtech	AJA-O6326

Database	Data ID
PubChem	22278899

M. W.

227.30004

CAS

324769-06-4

Similarity

N/A

ID: 52580

ethyl 4-oxopiperidine-1-carboxylate

$$$$ Data More

M. F.

C8H13NO3

Suppliers	Catalog Number
Sigma Aldrich	153737 02614
Alfa Aesar	A11833
Matrix Scientific	057234

Database	Data ID
PubChem	34767

M. W.

171.19372

CAS

29976-53-2

Similarity

N/A

ID: 52581

5-(piperidin-1-yl)pentan-1-ol

$$$$ Data

M. F.

C10H21NO

Suppliers	Catalog Number
Matrix Scientific	057235

Database	Data ID
PubChem	566537

M. W.

171.27984

CAS

2937-83-9

Similarity

N/A

ID: 52582

3-(piperidin-4-yl)benzonitrile

$$$$ Data

M. F.

C12H14N2

Suppliers	Catalog Number
Matrix Scientific	057236
A&J Pharmtech	AJA-O17127

Database	Data ID
PubChem	21448166

M. W.

186.25296

CAS

370864-72-5

Similarity

N/A

ID: 52583

6-bromo-1,2,3,4-tetrahydroquinoline

$$$$ Data More

M. F.

C9H10BrN

Suppliers	Catalog Number
Matrix Scientific	057237
Enamine	EN300-41796
Bide Pharmatech	BD40783

Database	Data ID
PubChem	4715029

M. W.

212.0864

CAS

22190-35-8

Similarity

N/A

ID: 52584

tert-butyl 2,6-diazaspiro[3.5]nonane-6-carboxylate

$$$$ Data

M. F.

C12H22N2O2

Suppliers	Catalog Number
Matrix Scientific	057238
Bide Pharmatech	BD145289

Database	Data ID
PubChem	24820496

M. W.

226.31528

CAS

885272-17-3

Similarity

N/A

ID: 52585

tert-butyl 2,6-diazaspiro[3.5]nonane-2-carboxylate

$$$$ Data

M. F.

C12H22N2O2

Suppliers	Catalog Number
Matrix Scientific	057239

Database	Data ID
PubChem	44182345

M. W.

226.31528

CAS

1086394-57-1

Similarity

N/A

ID: 52586

(2S,4S)-1-[(tert-butoxy)carbonyl]-4-hydroxy-2-methylpiperidine-2-carboxylic acid

$$$$ Data

M. F.

C12H21NO5

Suppliers	Catalog Number
Matrix Scientific	057240

Database	Data ID
PubChem	49757936

M. W.

259.29884

CAS

254882-14-9

Similarity

N/A

ID: 52587

6-ethylpiperidin-2-one

$$$$ Data

M. F.

C7H13NO

Suppliers	Catalog Number
Matrix Scientific	057243

Database	Data ID
PubChem	15889348

M. W.

127.18422

CAS

53611-44-2

Similarity

N/A

ID: 52588

4-benzoylpiperidine

$$$$ Data

M. F.

C12H15NO

Suppliers	Catalog Number
Matrix Scientific	057244
Enamine	EN300-26191

Database	Data ID
PubChem	226102

M. W.

189.2536

CAS

37586-22-4

Similarity

N/A

ID: 52589

tert-butyl 4-benzoylpiperidine-1-carboxylate

$$$$ Data

M. F.

C17H23NO3

Suppliers	Catalog Number
Matrix Scientific	057245

Database	Data ID
PubChem	10827307

M. W.

289.36942

CAS

193217-39-9

Similarity

N/A

ID: 52590

benzyl (2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

$$$$ Data

M. F.

C13H17NO4

Suppliers	Catalog Number
Sigma Aldrich	547085
Matrix Scientific	057246

Database	Data ID
PubChem	14994791

M. W.

251.27838

CAS

95687-41-5

Similarity

N/A

ID: 52591

(2S)-1-[(benzyloxy)carbonyl]-4-oxopyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C13H13NO5

Suppliers	Catalog Number
Sigma Aldrich	691755
Matrix Scientific	057247

Database	Data ID
PubChem	11076282

M. W.

263.24602

CAS

64187-47-9

Similarity

N/A

ID: 52592

(2S)-4-oxopyrrolidine-2-carboxylic acid hydrobromide

$$$$ Data

M. F.

C5H8BrNO3

Suppliers	Catalog Number
Sigma Aldrich	710962
Alfa Aesar	H57691
Matrix Scientific	057248

Database	Data ID
PubChem	12773661

M. W.

210.02592

CAS

75776-67-9

Similarity

N/A

ID: 52593

(2S,4S)-1-[(benzyloxy)carbonyl]-4-hydroxypyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C13H15NO5

Suppliers	Catalog Number
Matrix Scientific	057249

Database	Data ID
PubChem	688414

M. W.

265.2619

CAS

13504-86-4

Similarity

N/A

ID: 52594

(3R,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol hydrochloride

$$$$ Data

M. F.

C6H14ClNO2

Suppliers	Catalog Number
Matrix Scientific	057250

Database	Data ID
PubChem	50998341

M. W.

167.63386

CAS

107746-24-7

Similarity

N/A

ID: 52595

1-benzyl 2-methyl (2S)-4-oxopyrrolidine-1,2-dicarboxylate

$$$$ Data

M. F.

C14H15NO5

Suppliers	Catalog Number
Matrix Scientific	057251

Database	Data ID
PubChem	11594288

M. W.

277.2726

CAS

16217-15-5

Similarity

N/A

ID: 52596

1,2-dibenzyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate

$$$$ Data

M. F.

C20H21NO5

Suppliers	Catalog Number
Matrix Scientific	057252

Database	Data ID
PubChem	11783205

M. W.

355.38444

CAS

13500-53-3

Similarity

N/A

ID: 52597

1-tert-butyl 2-methyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate

$$$$ Data More

M. F.

C11H19NO5

Suppliers	Catalog Number
Sigma Aldrich	639737
Matrix Scientific	057253
Apollo Scientific	OR43520

Database	Data ID
PubChem	2734883

M. W.

245.27226

CAS

74844-91-0

Similarity

N/A

ID: 52598

1-tert-butyl 2-methyl (2S)-4-oxopyrrolidine-1,2-dicarboxylate

$$$$ Data More

M. F.

C11H17NO5

Suppliers	Catalog Number
Sigma Aldrich	702498
Alfa Aesar	H27782
Matrix Scientific	057255

Database	Data ID
PubChem	10988485

M. W.

243.25638

CAS

102195-80-2

Similarity

N/A

ID: 52599

1-(9H-fluoren-9-ylmethyl) 2-methyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylat...

$$$$ Data

M. F.

C21H21NO5

Suppliers	Catalog Number
Matrix Scientific	057256

Database	Data ID
PubChem	10981426

M. W.

367.39514

CAS

122350-59-8

Similarity

N/A

ID: 52600

(2S,4S)-4-amino-1-[(tert-butoxy)carbonyl]pyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C10H18N2O4

Suppliers	Catalog Number
Matrix Scientific	057257
Bide Pharmatech	BD48340

Database	Data ID
PubChem	14842624

M. W.

230.26092

CAS

132622-66-3

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