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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H31NO3
Molecular Weight 357.4864
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMICIBONE, (S)-

SMILES

O=C(OCC1=CC=CC=C1)[C@]3(CCN2CCCCCC2)CCCCC3=O

InChI

InChIKey=JGAVKVSEQOCHBG-QFIPXVFZSA-N
InChI=1S/C22H31NO3/c24-20-12-6-7-13-22(20,14-17-23-15-8-1-2-9-16-23)21(25)26-18-19-10-4-3-5-11-19/h3-5,10-11H,1-2,6-9,12-18H2/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H31NO3
Molecular Weight 357.4864
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:50:27 GMT 2025
Edited
by admin
on Mon Mar 31 22:50:27 GMT 2025
Record UNII
1TL94ZN96T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOHEXANECARBOXYLIC ACID, 1-(2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL)-2-OXO-, PHENYLMETHYL ESTER, (S)-
Preferred Name English
AMICIBONE, (S)-
Common Name English
Code System Code Type Description
FDA UNII
1TL94ZN96T
Created by admin on Mon Mar 31 22:50:27 GMT 2025 , Edited by admin on Mon Mar 31 22:50:27 GMT 2025
PRIMARY
PUBCHEM
76958638
Created by admin on Mon Mar 31 22:50:27 GMT 2025 , Edited by admin on Mon Mar 31 22:50:27 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER