Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C9H11FO2

Suppliers	Catalog Number
Sigma Aldrich	749109
Apollo Scientific	PC57020

Database	Data ID
PubChem	11426732

M. W.

170.1808432

CAS

90470-67-0

Similarity

N/A

ID: 98502

2,6-difluoro-3-nitroaniline

$$$$ Data

M. F.

C6H4F2N2O2

Suppliers	Catalog Number
Apollo Scientific	PC57022

Database	Data ID
PubChem	21760272

M. W.

174.1049664

CAS

25892-09-5

Similarity

N/A

ID: 98503

1-chloro-3-fluoro-2-isothiocyanatobenzene

$$$$ Data

M. F.

C7H3ClFNS

Suppliers	Catalog Number
Apollo Scientific	PC57023

Database	Data ID
PubChem	26599140

M. W.

187.6218232

CAS

899806-25-8

Similarity

N/A

ID: 98504

2-methanesulfonyl-5-(trifluoromethyl)benzonitrile

$$$$ Data

M. F.

C9H6F3NO2S

Suppliers	Catalog Number
Apollo Scientific	PC57024

Database	Data ID
PubChem	71299642

M. W.

249.2096496

CAS

Similarity

N/A

ID: 98505

3-[3-(trifluoromethyl)phenyl]propan-1-ol

$$$$ Data More

M. F.

C10H11F3O

Suppliers	Catalog Number
Apollo Scientific	PC57025
TRC	T791110
Bide Pharmatech	BD79835

Database	Data ID
PubChem	18755618

M. W.

204.1889496

CAS

78573-45-2

Similarity

N/A

ID: 98506

2,6-difluoro-3-methoxyaniline

$$$$ Data

M. F.

C7H7F2NO

Suppliers	Catalog Number
Alfa Aesar	H26631
Apollo Scientific	PC57026

Database	Data ID
PubChem	3871278

M. W.

159.1333864

CAS

144851-62-7

Similarity

N/A

ID: 98507

2-amino-2-(4-fluorophenyl)acetonitrile hydrochloride

$$$$ Data

M. F.

C8H8ClFN2

Suppliers	Catalog Number
Apollo Scientific	PC57027

Database	Data ID
PubChem	12339416

M. W.

186.6139232

CAS

934830-01-0

Similarity

N/A

ID: 98508

1-(2,5-difluorophenyl)-2-trifluoromethanesulfonylethan-1-one

$$$$ Data

M. F.

C9H5F5O3S

Suppliers	Catalog Number
Apollo Scientific	PC57028

Database	Data ID
PubChem	56776503

M. W.

288.191216

CAS

Similarity

N/A

ID: 98509

1,1,1,3,3-pentafluoropropane

$$$$ Data

M. F.

C3H3F5

Suppliers	Catalog Number
Apollo Scientific	PC5702D

Database	Data ID
Wikipedia	Pentafluoropropane
PubChem	68030

M. W.

134.047936

CAS

460-73-1

Similarity

N/A

ID: 98510

3-bromo-1,1,2,3,3-pentafluoroprop-1-ene

$$$$ Data

M. F.

C3BrF5

Suppliers	Catalog Number
Apollo Scientific	PC5705

Database	Data ID
PubChem	14047952

M. W.

210.928116

CAS

431-56-1

Similarity

N/A

ID: 98511

2-fluoro-5-(trifluoromethoxy)phenol

$$$$ Data

M. F.

C7H4F4O2

Suppliers	Catalog Number
Alfa Aesar	H26535
Apollo Scientific	PC5707

Database	Data ID
PubChem	3790875

M. W.

196.0990728

CAS

886498-03-9

Similarity

N/A

ID: 98512

2-methoxy-5-(trifluoromethyl)benzoic acid

$$$$ Data

M. F.

C9H7F3O3

Suppliers	Catalog Number
Alfa Aesar	H26362
Maybridge	MAY00126
Apollo Scientific	PC5709

Database	Data ID
PubChem	13585909

M. W.

220.1452896

CAS

4864-01-1

Similarity

N/A

ID: 98513

methyl[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amine

$$$$ Data

M. F.

C10H12F3N

Suppliers	Catalog Number
Apollo Scientific	PC5978 PC5710

Database	Data ID
PubChem	24888886

M. W.

203.2041896

CAS

672906-72-8

Similarity

N/A

ID: 98514

potassium trifluoromethanesulfinate

$$$$ Data

M. F.

CF3KO2S

Suppliers	Catalog Number
Apollo Scientific	PC5712

Database	Data ID
PubChem	2733643

M. W.

172.1680096

CAS

41804-89-1

Similarity

N/A

ID: 98515

ethyl 3,3,3-trifluoro-2-hydroxypropanoate

$$$$ Data

M. F.

C5H7F3O3

Suppliers	Catalog Number
Apollo Scientific	PC5713

Database	Data ID
PubChem	2758935

M. W.

172.1024896

CAS

94726-00-8

Similarity

N/A

ID: 98516

4-(acetyloxy)-2,3,5,6-tetrafluorobenzoic acid

$$$$ Data

M. F.

C9H4F4O4

Suppliers	Catalog Number
Apollo Scientific	PC5714

Database	Data ID
PubChem	2737625

M. W.

252.1192728

CAS

Similarity

N/A

ID: 98517

N-[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)phenyl]acetamide

$$$$ Data

M. F.

C15H19BF3NO3

Suppliers	Catalog Number
Apollo Scientific	PC5715
Bide Pharmatech	BD230274

Database	Data ID
PubChem	45933677

M. W.

329.1224696

CAS

1150271-57-0

Similarity

N/A

ID: 98518

4-fluoro-3-methoxy-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

$$$$ Data

M. F.

C14H17BFNO3

Suppliers	Catalog Number
Apollo Scientific	PC5716
Bide Pharmatech	BD231464

Database	Data ID
PubChem	45933678

M. W.

277.0990832

CAS

1150561-55-9

Similarity

N/A

ID: 98519

(2S,4R)-4-fluoropyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C5H8FNO2

Suppliers	Catalog Number
Apollo Scientific	PC5718
Enamine	EN300-89701
A&J Pharmtech	AJA-O34252

Database	Data ID
PubChem	11902999

M. W.

133.1209232

CAS

2507-61-1

Similarity

N/A

ID: 98520

(2S,4S)-4-fluoropyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C5H8FNO2

Suppliers	Catalog Number
Apollo Scientific	PC5719
Enamine	EN300-67319
A&J Pharmtech	AJA-O34253

Database	Data ID
PubChem	10057550

M. W.

133.1209232

CAS

6745-32-0

Similarity

N/A

ID: 98521

1-bromo-4-(bromomethyl)-2-fluorobenzene

$$$$ Data More

M. F.

C7H5Br2F

Suppliers	Catalog Number
Alfa Aesar	H59275
Apollo Scientific	PC5721
Chemik	CHB00134

Database	Data ID
PubChem	11666176

M. W.

267.9210032

CAS

127425-73-4

Similarity

N/A

ID: 98522

2,3-dibromo-1,1,1,2-tetrafluoropropane

$$$$ Data

M. F.

C3H2Br2F4

Suppliers	Catalog Number
Apollo Scientific	PC5724

Database	Data ID
PubChem	45075707

M. W.

273.8495928

CAS

421-92-1

Similarity

N/A

ID: 98523

3,4-dibromo-1,1,1,3-tetrafluorobutane

$$$$ Data

M. F.

C4H4Br2F4

Suppliers	Catalog Number
Apollo Scientific	PC5726

Database	Data ID
PubChem	45075711

M. W.

287.8761728

CAS

Similarity

N/A

ID: 98524

2,3-dibromo-1,1,1,3-tetrafluorobutane

$$$$ Data

M. F.

C4H4Br2F4

Suppliers	Catalog Number
Apollo Scientific	PC5727

Database	Data ID
PubChem	45075710

M. W.

287.8761728

CAS

933600-85-2

Similarity

N/A

ID: 98525

1,1,2-tribromo-1-fluoroethane

$$$$ Data

M. F.

C2H2Br3F

Suppliers	Catalog Number
Apollo Scientific	PC5728

Database	Data ID
PubChem	20141252

M. W.

284.7476832

CAS

420-88-2

Similarity

N/A

ID: 98526

1,1,2-tribromo-1,2-difluoroethane

$$$$ Data

M. F.

C2HBr3F2

Suppliers	Catalog Number
Apollo Scientific	PC5729

Database	Data ID
PubChem	5463746

M. W.

302.7381464

CAS

353-97-9

Similarity

N/A

ID: 98527

1-bromo-3,3,4,4-tetrafluorohexane

$$$$ Data

M. F.

C6H9BrF4

Suppliers	Catalog Number
Apollo Scientific	PC5731

Database	Data ID
PubChem	45933679

M. W.

237.0332728

CAS

151831-48-0

Similarity

N/A

ID: 98528

1-bromo-1,1-dichloro-2,2,2-trifluoroethane

$$$$ Data

M. F.

C2BrCl2F3

Suppliers	Catalog Number
Apollo Scientific	PC5733

Database	Data ID
PubChem	39178

M. W.

231.8266096

CAS

354-50-7

Similarity

N/A

ID: 98529

2-hydroxy-5-(trifluoromethyl)benzoic acid

$$$$ Data

M. F.

C8H5F3O3

Suppliers	Catalog Number
Apollo Scientific	PC5736
Bide Pharmatech	BD212132

Database	Data ID
PubChem	11117203

M. W.

206.1187096

CAS

79427-88-6

Similarity

N/A

ID: 98530

1,3-difluoroprop-1-ene

$$$$ Data

M. F.

C3H4F2

Suppliers	Catalog Number
Apollo Scientific	PC5737

Database	Data ID
PubChem	18413637

M. W.

78.0606664

CAS

58777-28-9

Similarity

N/A

ID: 98531

4-bromo-3-(trifluoromethyl)benzaldehyde

$$$$ Data

M. F.

C8H4BrF3O

Suppliers	Catalog Number
Apollo Scientific	PC5738
Bide Pharmatech	BD95089
A&J Pharmtech	AJA-O2898

Database	Data ID
PubChem	12187220

M. W.

253.0159696

CAS

34328-47-7

Similarity

N/A

ID: 98532

1,1,1,4,4,4-hexafluoro-2-(trifluoromethyl)but-2-ene

$$$$ Data

M. F.

C5HF9

Suppliers	Catalog Number
Apollo Scientific	PC5739

Database	Data ID
PubChem	11053485

M. W.

232.0470688

CAS

22692-37-1

Similarity

N/A

ID: 98533

2-phenyl-4-(trifluoromethyl)-1H-imidazole

$$$$ Data

M. F.

C10H7F3N2

Suppliers	Catalog Number
Apollo Scientific	PC5741
A&J Pharmtech	AJA-O11657

Database	Data ID
PubChem	611358

M. W.

212.1711896

CAS

33469-36-2

Similarity

N/A

ID: 98534

2-(2-chlorophenyl)-4-(trifluoromethyl)-1H-imidazole

$$$$ Data

M. F.

C10H6ClF3N2

Suppliers	Catalog Number
Apollo Scientific	PC5742

Database	Data ID
PubChem	38372321

M. W.

246.6162496

CAS

Similarity

N/A

ID: 98535

3,3,4,4,5,5,6,6,6-nonafluoro-1-nitrohex-1-ene

$$$$ Data

M. F.

C6H2F9NO2

Suppliers	Catalog Number
Apollo Scientific	PC5743

Database	Data ID
PubChem	5708663

M. W.

291.0712088

CAS

Similarity

N/A

ID: 98536

2-(3-chlorophenyl)-4-(trifluoromethyl)-1H-imidazole

$$$$ Data

M. F.

C10H6ClF3N2

Suppliers	Catalog Number
Apollo Scientific	PC5744

Database	Data ID
PubChem	12811211

M. W.

246.6162496

CAS

Similarity

N/A

ID: 98537

4-[4-(trifluoromethyl)-1H-imidazol-2-yl]pyridine

$$$$ Data

M. F.

C9H6F3N3

Suppliers	Catalog Number
Apollo Scientific	PC5745
A&J Pharmtech	AJA-O11652

Database	Data ID
PubChem	611634

M. W.

213.1592496

CAS

33468-83-6

Similarity

N/A

ID: 98538

2-[4-(trifluoromethyl)-1H-imidazol-2-yl]pyridine

$$$$ Data

M. F.

C9H6F3N3

Suppliers	Catalog Number
Apollo Scientific	PC5747
A&J Pharmtech	AJA-O11654

Database	Data ID
PubChem	38372318

M. W.

213.1592496

CAS

33468-85-8

Similarity

N/A

ID: 98539

2-(4-methylphenyl)-4-(trifluoromethyl)-1H-imidazole

$$$$ Data

M. F.

C11H9F3N2

Suppliers	Catalog Number
Apollo Scientific	PC5748
Bide Pharmatech	BD78425
A&J Pharmtech	AJA-O11656

Database	Data ID
PubChem	10537210

M. W.

226.1977696

CAS

33469-18-0

Similarity

N/A

ID: 98540

[2-(trifluoromethyl)pyridin-4-yl]boronic acid

$$$$ Data

M. F.

C6H5BF3NO2

Suppliers	Catalog Number
Apollo Scientific	PC5751
A&J Pharmtech	AJA-O38090

Database	Data ID
PubChem	45158880

M. W.

190.9156096

CAS

1093407-58-9

Similarity

N/A

ID: 98541

2-(5-bromo-2,3-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

$$$$ Data

M. F.

C12H14BBrF2O2

Suppliers	Catalog Number
Apollo Scientific	PC5752
Bide Pharmatech	BD230076

Database	Data ID
PubChem	45933680

M. W.

318.9501664

CAS

1073339-12-4

Similarity

N/A

ID: 98542

2-(4-bromo-2-fluoro-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

$$$$ Data

M. F.

C13H17BBrFO3

Suppliers	Catalog Number
Apollo Scientific	PC5753
Bide Pharmatech	BD230074

Database	Data ID
PubChem	45933681

M. W.

330.9856832

CAS

1150271-71-8

Similarity

N/A

ID: 98543

2-[3-bromo-4-(trifluoromethoxy)phenyl]-2,2-difluoroacetic acid

$$$$ Data

M. F.

C9H4BrF5O3

Suppliers	Catalog Number
Apollo Scientific	PC5754

Database	Data ID
PubChem	45933682

M. W.

335.022276

CAS

Similarity

N/A

ID: 98544

2,3,3-trifluoroprop-1-ene

$$$$ Data

M. F.

C3H3F3

Suppliers	Catalog Number
Apollo Scientific	PC5756

Database	Data ID
PubChem	19050220

M. W.

96.0511296

CAS

158664-13-2

Similarity

N/A

ID: 98545

1,1,4,4,4-pentafluoro-2-(trifluoromethyl)but-1-ene

$$$$ Data

M. F.

C5H2F8

Suppliers	Catalog Number
Apollo Scientific	PC5757

Database	Data ID
PubChem	45933683

M. W.

214.0566056

CAS

400-17-9

Similarity

N/A

ID: 98546

pentafluoropropanenitrile

$$$$ Data

M. F.

C3F5N

Suppliers	Catalog Number
Apollo Scientific	PC5758

Database	Data ID
PubChem	67906

M. W.

145.030816

CAS

422-04-8

Similarity

N/A

ID: 98547

2-chloro-1,1,1,3-tetrafluorobut-2-ene

$$$$ Data

M. F.

C4H3ClF4

Suppliers	Catalog Number
Apollo Scientific	PC5759

Database	Data ID
PubChem	45075675

M. W.

162.5132328

CAS

8885276-06-2

Similarity

N/A

ID: 98548

(4-methoxyphenyl)diphenyl-$l^{4}-sulfanyl trifluoromethanesulfonate

$$$$ Data

M. F.

C20H17F3O4S2

Suppliers	Catalog Number
Apollo Scientific	PC5760

Database	Data ID
PubChem	2782338

M. W.

442.4717896

CAS

116808-67-4

Similarity

N/A

ID: 98549

(4-methylphenyl)diphenyl-$l^{4}-sulfanyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-su...

$$$$ Data

M. F.

C23H17F9O3S2

Suppliers	Catalog Number
Apollo Scientific	PC5761

Database	Data ID
PubChem	2782340

M. W.

576.4949088

CAS

Similarity

N/A

ID: 98550

(4-methylphenyl)diphenyl-$l^{4}-sulfanyl trifluoromethanesulfonate

$$$$ Data

M. F.

C20H17F3O3S2

Suppliers	Catalog Number
Apollo Scientific	PC5762

Database	Data ID
PubChem	2782341

M. W.

426.4723896

CAS

81416-37-7

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