IngredientID 34059

Stilon

C6H11NO

Relationship Network

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Herb: 3Ingredient: 1Target: 2Links: 5

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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id: 34059
Core Entity Id: 41054
Source Entity Count: 1
Preferred Name: Stilon
Name En
Pubchem Id: 7768
Smiles Canonical: C1CCC(=O)NCC1
Molecular Formula: C6H11NO
Molecular Weight: 113.1600
Inchikey: JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Inchi: InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)
Isomeric Smiles: C1CCC(=O)NCC1
Cas Id: 34876-18-1
Ob Score: 54.7050
Mol Logp: 0.6766
Num H Donors: 1
Num H Acceptors: 1
Num Rotatable Bonds: 0
Drug Likeness: 0.4910
Polar Surface Area
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name

Stilon

Role

preferred

Source

HERB_v2

Preferred

Yes

Name

Stilon

Role

preferred

Source

itcmdb_public

Preferred

Yes

Name

Stilon

Role

preferred

Source

TCMBank

Preferred

Yes

Name

Stilon

Role

preferred

Source

SymMap_v2

Preferred

Yes

Name

.omega.-Caprolactam

Role

alias

Source

TCMBank

Preferred

Name

1,6-Hexalactam

Role

alias

Source

TCMBank

Preferred

Name

1,6-Hexolactam

Role

alias

Source

TCMBank

Preferred

Name

1-Aza-2-cycloheptanone

Role

alias

Source

TCMBank

Preferred

Name

105-60-2

Role

alias

Source

TCMBank

Preferred

Name

105-60-2

Role

alias

Source

itcmdb_public

Preferred

Name

105-60-2

Role

alias

Source

HERB_v2

Preferred

Name

117955-36-9

Role

alias

Source

TCMBank

Preferred

Name

168214-28-6

Role

alias

Source

TCMBank

Preferred

Name

2-Azacycloheptanone

Role

alias

Source

itcmdb_public

Preferred

Name

2-Azacycloheptanone

Role

alias

Source

HERB_v2

Preferred

Name

2-Azacycloheptanone

Role

alias

Source

TCMBank

Preferred

Name

2-Azepinone, hexahydro-, (Z)-

Role

alias

Source

TCMBank

Preferred

Name

2-Ketohexamethylenimine

Role

alias

Source

TCMBank

Preferred

Name

2-Oxohexamethyleneimine

Role

alias

Source

TCMBank

Preferred

Name

2-Oxohexamethylenimine

Role

alias

Source

TCMBank

Preferred

Name

2-Oxohexamethylenimine

Role

alias

Source

itcmdb_public

Preferred

Name

2-Oxohexamethylenimine

Role

alias

Source

HERB_v2

Preferred

Name

2-Perhydroazepinone

Role

alias

Source

TCMBank

Preferred

Name

2-azepanone

Role

alias

Source

TCMBank

Preferred

Name

2-ketohexamethyleneimine

Role

alias

Source

TCMBank

Preferred

Name

21500_FLUKA

Role

alias

Source

TCMBank

Preferred

Name

240591_ALDRICH

Role

alias

Source

TCMBank

Preferred

Name

2953-03-9

Role

alias

Source

TCMBank

Preferred

Name

2H-Azepin-2-one, hexahydro-

Role

alias

Source

TCMBank

Preferred

Name

2H-Azepin-7-one, hexahydro-

Role

alias

Source

TCMBank

Preferred

Name

32838-21-4

Role

alias

Source

TCMBank

Preferred

Name

32838-23-6

Role

alias

Source

TCMBank

Preferred

Name

34876-18-1

Role

alias

Source

TCMBank

Preferred

Name

5-21-06-00444 (Beilstein Handbook Reference)

Role

alias

Source

TCMBank

Preferred

Name

6-Aminocaproic acid lactam

Role

alias

Source

TCMBank

Preferred

Name

6-Aminohexanoic acid cyclic lactam

Role

alias

Source

TCMBank

Preferred

Name

6-Caprolactam

Role

alias

Source

itcmdb_public

Preferred

Name

6-Caprolactam

Role

alias

Source

TCMBank

Preferred

Name

6-Caprolactam

Role

alias

Source

HERB_v2

Preferred

Name

6-Hexanelactam

Role

alias

Source

TCMBank

Preferred

Name

6-Hexanelactam

Role

alias

Source

itcmdb_public

Preferred

Name

6-Hexanelactam

Role

alias

Source

HERB_v2

Preferred

Name

A1030

Role

alias

Source

TCMBank

Preferred

Name

AI3-14515

Role

alias

Source

TCMBank

Preferred

Name

AIDS018627

Role

alias

Source

TCMBank

Preferred

Name

Aminocaproic lactam

Role

alias

Source

itcmdb_public

Preferred

Name

Aminocaproic lactam

Role

alias

Source

HERB_v2

Preferred

Name

Aminocaproic lactam

Role

alias

Source

TCMBank

Preferred

Name

Aza-2-cycloheptanone

Role

alias

Source

TCMBank

Preferred

Name

BRN 0106934

Role

alias

Source

TCMBank

Preferred

Name

C06593

Role

alias

Source

TCMBank

Preferred

Name

C2204_ALDRICH

Role

alias

Source

TCMBank

Preferred

Name

CAPROLACTAM

Role

alias

Source

itcmdb_public

Preferred

Name

CAPROLACTAM

Role

alias

Source

HERB_v2

Preferred

Name

CCRIS 119

Role

alias

Source

TCMBank

Preferred

Name

CHEBI:28579

Role

alias

Source

TCMBank

Preferred

Name

CM3900000

Role

alias

Source

TCMBank

Preferred

Name

Caprolactam

Role

alias

Source

TCMBank

Preferred

Name

Caprolactam dust and vapor

Role

alias

Source

TCMBank

Preferred

Name

Caprolactam monomer

Role

alias

Source

TCMBank

Preferred

Name

Caprolactam solution

Role

alias

Source

TCMBank

Preferred

Name

Caprolattame

Role

alias

Source

TCMBank

Preferred

Name

Caprolattame [French]

Role

alias

Source

TCMBank

Preferred

Name

Capron PK4

Role

alias

Source

TCMBank

Preferred

Name

Cyclohexanone iso-oxime

Role

alias

Source

TCMBank

Preferred

Name

E-caprolactum

Role

alias

Source

TCMBank

Preferred

Name

EINECS 203-313-2

Role

alias

Source

TCMBank

Preferred

Name

Epsylon kaprolaktam

Role

alias

Source

TCMBank

Preferred

Name

Epsylon kaprolaktam [Polish]

Role

alias

Source

TCMBank

Preferred

Name

Extrom 6N

Role

alias

Source

TCMBank

Preferred

Name

HEXANOIC ACID,6-AMINO,LACTAM E-CAPROLACTAM

Role

alias

Source

TCMBank

Preferred

Name

HSDB 187

Role

alias

Source

TCMBank

Preferred

Name

Hexahydro-2-azepinone

Role

alias

Source

TCMBank

Preferred

Name

Hexahydro-2H-azepin-2-one

Role

alias

Source

HERB_v2

Preferred

Name

Hexahydro-2H-azepin-2-one

Role

alias

Source

TCMBank

Preferred

Name

Hexahydro-2H-azepin-2-one

Role

alias

Source

itcmdb_public

Preferred

Name

Hexahydro-2H-azepin-2-one (9CI)

Role

alias

Source

TCMBank

Preferred

Name

Hexamethylenimine, 2-oxo-

Role

alias

Source

TCMBank

Preferred

Name

Hexanoic acid, 6-amino-, cyclic lactam

Role

alias

Source

TCMBank

Preferred

Name

Hexanolactam

Role

alias

Source

TCMBank

Preferred

Name

Hexanone isoxime

Role

alias

Source

TCMBank

Preferred

Name

Hexanonisoxim

Role

alias

Source

TCMBank

Preferred

Name

Hexanonisoxim [German]

Role

alias

Source

TCMBank

Preferred

Name

InChI=1/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8

Role

alias

Source

TCMBank

Preferred

Name

Kaprolaktam

Role

alias

Source

TCMBank

Preferred

Name

Kapromine

Role

alias

Source

TCMBank

Preferred

Name

NCI-C50646

Role

alias

Source

TCMBank

Preferred

Name

NSC 117393

Role

alias

Source

TCMBank

Preferred

Name

NSC25536

Role

alias

Source

TCMBank

Preferred

Name

NSC4977

Role

alias

Source

TCMBank

Preferred

Name

Perhydroazepin-2-one

Role

alias

Source

TCMBank

Preferred

Name

ST5308104

Role

alias

Source

TCMBank

Preferred

Name

W423501_ALDRICH

Role

alias

Source

TCMBank

Preferred

Name

WLN: T7MVTJ

Role

alias

Source

TCMBank

Preferred

Name

ZINC00394707

Role

alias

Source

TCMBank

Preferred

Name

azepan-2-one

Role

alias

Source

TCMBank

Preferred

Name

azepan-2-one

Role

alias

Source

HERB_v2

Preferred

Name

azepan-2-one

Role

alias

Source

itcmdb_public

Preferred

Name

c0432

Role

alias

Source

TCMBank

Preferred

Name

cis-Hexahydro-2-azepinone

Role

alias

Source

TCMBank

Preferred

Name

e-Kaprolaktam

Role

alias

Source

TCMBank

Preferred

Name

e-Kaprolaktam [Czech]

Role

alias

Source

TCMBank

Preferred

Name

epsilon-Caprolactam

Role

alias

Source

HERB_v2

Preferred

Name

epsilon-Caprolactam

Role

alias

Source

TCMBank

Preferred

Name

epsilon-Caprolactam

Role

alias

Source

itcmdb_public

Preferred

Name

gamma-caprolactam

Role

alias

Source

TCMBank

Preferred

Name

hexannic acid

Role

alias

Source

TCMBank

Preferred

Name

hexanoic acid-6-amino-,lactam

Role

alias

Source

TCMBank

Preferred

Name

omega-caprolactum

Role

alias

Source

TCMBank

Preferred

Aliases

Additional names normalized into the restored final schema.

.omega.-Caprolactam1,6-Hexalactam1,6-Hexolactam1-Aza-2-cycloheptanone105-60-2117955-36-9168214-28-62-Azacycloheptanone2-Azepinone, hexahydro-, (Z)-2-Ketohexamethylenimine2-Oxohexamethyleneimine2-Oxohexamethylenimine2-Perhydroazepinone2-azepanone2-ketohexamethyleneimine21500_FLUKA240591_ALDRICH2953-03-92H-Azepin-2-one, hexahydro-2H-Azepin-7-one, hexahydro-32838-21-432838-23-634876-18-15-21-06-00444 (Beilstein Handbook Reference)6-Aminocaproic acid lactam6-Aminohexanoic acid cyclic lactam6-Caprolactam6-HexanelactamA1030AI3-14515AIDS018627Aminocaproic lactamAza-2-cycloheptanoneBRN 0106934C06593C2204_ALDRICHCAPROLACTAMCCRIS 119CHEBI:28579CM3900000Caprolactam dust and vaporCaprolactam monomerCaprolactam solutionCaprolattameCaprolattame [French]Capron PK4Cyclohexanone iso-oximeE-caprolactumEINECS 203-313-2Epsylon kaprolaktamEpsylon kaprolaktam [Polish]Extrom 6NHEXANOIC ACID,6-AMINO,LACTAM E-CAPROLACTAMHSDB 187Hexahydro-2-azepinoneHexahydro-2H-azepin-2-oneHexahydro-2H-azepin-2-one (9CI)Hexamethylenimine, 2-oxo-Hexanoic acid, 6-amino-, cyclic lactamHexanolactamHexanone isoximeHexanonisoximHexanonisoxim [German]InChI=1/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8KaprolaktamKapromineNCI-C50646NSC 117393NSC25536NSC4977Perhydroazepin-2-oneST5308104W423501_ALDRICHWLN: T7MVTJZINC00394707azepan-2-onec0432cis-Hexahydro-2-azepinonee-Kaprolaktame-Kaprolaktam [Czech]epsilon-Caprolactamgamma-caprolactamhexannic acidhexanoic acid-6-amino-,lactamomega-caprolactum

Cross References

Trusted external identifiers retained for this final record.

Cas

34876-18-1

Herb

HBIN029326HBIN044952

Npass

NPC111686

Tcmid

33877

Tcmsp

MOL008315

Sym Map

SMIT09623

Pub Chem

7768

Tcmbank

TCMBANKIN058607

Attributes

Merged source attributes and domain-specific metadata.

Type

Other ingredients

In Ch I

InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)

Mol Wt

113.16

Cas Id

34876-18-1

Smiles

C1CCC(=O)NCC1

Mol Log P

0.6766000000000001

Version

v1,v2

In Ch Ikey

JBKVHLHDHHXQEQ-UHFFFAOYSA-N

Ob Score

54.70554.70537554.70537507

Suppress

Num Hdonors

Drug Likeness

0.491

Num Hacceptors

Isomeric Smiles

C1CCC(=O)NCC1

Molecule Weight

113.18

Canonical Smiles

C1CCC(=O)NCC1

Herb Alias Names

azepan-2-oneCAPROLACTAMepsilon-Caprolactam105-60-22-Oxohexamethylenimine6-CaprolactamAminocaproic lactam6-Hexanelactam2-AzacycloheptanoneHexahydro-2H-azepin-2-one

Molecular Weight

113.16 g/mol

Molecular Formula

C6H11NO

Molecular Formula

C6H11NO

Num Rotatable Bonds