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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H27NO
Molecular Weight 285.4238
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTAZOCINE, (+)-

SMILES

C[C@@H]1[C@@H]2CC3=CC=C(O)C=C3[C@@]1(C)CCN2CC=C(C)C

InChI

InChIKey=VOKSWYLNZZRQPF-CCKFTAQKSA-N
InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H27NO
Molecular Weight 285.4238
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q99720|||Q7Z653
Gene ID: 10280.0
Gene Symbol: SIGMAR1
Target Organism: Homo sapiens (Human)
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:43:58 UTC 2023
Edited
by admin
on Sat Dec 16 07:43:58 UTC 2023
Record UNII
A2G9VU2P2J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTAZOCINE, (+)-
Systematic Name English
PENTAZOCINE, D-
Common Name English
PENTAZOCINE 2S,6S,11S-FORM [MI]
Common Name English
2,6-METHANO-3-BENZAZOCIN-8-OL, 1,2,3,4,5,6-HEXAHYDRO-6,11-DIMETHYL-3-(3-METHYL-2-BUTEN-1-YL)-, (2S,6S,11S)-
Systematic Name English
(+)-.ALPHA.-PENTAZOCINE
Common Name English
D-PENTAZOCINE
Common Name English
(+)-CIS-PENTAZOCINE
Common Name English
(+)-PENTAZOCINE
Common Name English
Code System Code Type Description
MERCK INDEX
m8503
Created by admin on Sat Dec 16 07:43:59 UTC 2023 , Edited by admin on Sat Dec 16 07:43:59 UTC 2023
PRIMARY Merck Index
FDA UNII
A2G9VU2P2J
Created by admin on Sat Dec 16 07:43:59 UTC 2023 , Edited by admin on Sat Dec 16 07:43:59 UTC 2023
PRIMARY
CAS
7361-76-4
Created by admin on Sat Dec 16 07:43:59 UTC 2023 , Edited by admin on Sat Dec 16 07:43:59 UTC 2023
PRIMARY
PUBCHEM
12259685
Created by admin on Sat Dec 16 07:43:59 UTC 2023 , Edited by admin on Sat Dec 16 07:43:59 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
TARGET -> AGONIST
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER