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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H29NO2
Molecular Weight 315.4498
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Bremazocine, (-)-

SMILES

CC[C@]12CCN(CC3(O)CC3)[C@H](CC4=CC=C(O)C=C14)C2(C)C

InChI

InChIKey=ZDXGFIXMPOUDFF-XLIONFOSSA-N
InChI=1S/C20H29NO2/c1-4-20-9-10-21(13-19(23)7-8-19)17(18(20,2)3)11-14-5-6-15(22)12-16(14)20/h5-6,12,17,22-23H,4,7-11,13H2,1-3H3/t17-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H29NO2
Molecular Weight 315.4498
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:56:28 UTC 2023
Edited
by admin
on Sat Dec 16 19:56:28 UTC 2023
Record UNII
FDR3CJ69GC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Bremazocine, (-)-
Common Name English
(2R,6S)-6-Ethyl-1,2,3,4,5,6-hexahydro-3-[(1-hydroxycyclopropyl)methyl]-11,11-dimethyl-2,6-methano-3-benzazocin-8-ol
Common Name English
(-)-Bremazocine
Common Name English
2,6-Methano-3-benzazocin-8-ol, 6-ethyl-1,2,3,4,5,6-hexahydro-3-[(1-hydroxycyclopropyl)methyl]-11,11-dimethyl-, (2R,6S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID001317125
Created by admin on Sat Dec 16 19:56:29 UTC 2023 , Edited by admin on Sat Dec 16 19:56:29 UTC 2023
PRIMARY
FDA UNII
FDR3CJ69GC
Created by admin on Sat Dec 16 19:56:29 UTC 2023 , Edited by admin on Sat Dec 16 19:56:29 UTC 2023
PRIMARY
PUBCHEM
443406
Created by admin on Sat Dec 16 19:56:29 UTC 2023 , Edited by admin on Sat Dec 16 19:56:29 UTC 2023
PRIMARY
CAS
75684-07-0
Created by admin on Sat Dec 16 19:56:29 UTC 2023 , Edited by admin on Sat Dec 16 19:56:29 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
AGONIST -> TARGET
RACEMATE -> ACTIVE ENANTIOMER