U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C19H27NO.ClH
Molecular Weight 321.885
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTAZOCINE HYDROCHLORIDE

SMILES

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

InChI

InChIKey=OQGYMIIFOSJQSF-DTOXXUQYSA-N
InChI=1S/C19H27NO.ClH/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;1H/t14-,18+,19+;/m0./s1

HIDE SMILES / InChI
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
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

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:00:06 UTC 2023
Edited
by admin
on Fri Dec 15 16:00:06 UTC 2023
Record UNII
A36BXO4PPX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTAZOCINE HYDROCHLORIDE
EP   JAN   MART.   MI   ORANGE BOOK   USAN   USP   VANDF   WHO-DD  
USAN  
Official Name English
PENTAZOCINE HYDROCHLORIDE [VANDF]
Common Name English
PENTAZOCINE HYDROCHLORIDE [MI]
Common Name English
PENTAZOCINE HYDROCHLORIDE [USP MONOGRAPH]
Common Name English
PENTAZOCINE HYDROCHLORIDE COMPONENT OF TALWIN COMPOUND
Common Name English
PENTAZOCINE HYDROCHLORIDE [ORANGE BOOK]
Common Name English
TALACEN COMPONENT PENTAZOCINE HYDROCHLORIDE
Common Name English
PENTAZOCINE HYDROCHLORIDE [EP MONOGRAPH]
Common Name English
TALWIN NX COMPONENT PENTAZOCINE HYDROCHLORIDE
Common Name English
2,6-METHANO-3-BENZAZOCIN-8-OL, 1,2,3,4,5,6-HEXAHYDRO-6,11-DIMETHYL-3-(3-METHYL-2-BUTENYL)-, HYDROCHLORIDE, (2.ALPHA.,6.ALPHA.,11R*)-
Common Name English
PENTAZOCINE HYDROCHLORIDE COMPONENT OF TALWIN NX
Common Name English
TALWIN 50
Brand Name English
PENTAZOCINE HYDROCHLORIDE [USAN]
Common Name English
PENTAZOCINE HYDROCHLORIDE COMPONENT OF TALACEN
Common Name English
PENTAZOCINE HYDROCHLORIDE [MART.]
Common Name English
(2R*,6R*,11R*)-1,2,3,4,5,6-HEXAHYDRO-6,11-DIMETHYL-3-(3-METHYL-2-BUTENYL)-2,6-METHANO-3-BENZAZOCIN-8-OL HYDROCHLORIDE
Common Name English
TALWIN COMPOUND COMPONENT PENTAZOCINE HYDROCHLORIDE
Common Name English
PENTAZOCINE HCL
Common Name English
Pentazocine hydrochloride [WHO-DD]
Common Name English
PENTAZOCINE HYDROCHLORIDE [JAN]
Common Name English
Classification Tree Code System Code
DEA NO. 9709
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
NCI_THESAURUS C67413
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
Code System Code Type Description
EVMPD
SUB03685MIG
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
RXCUI
104973
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY RxNorm
CAS
2276-52-0
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
ECHA (EC/EINECS)
218-896-9
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
ALTERNATIVE
PUBCHEM
441277
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
SMS_ID
100000085525
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
FDA UNII
A36BXO4PPX
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
MERCK INDEX
m8503
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY Merck Index
NCI_THESAURUS
C47661
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
DAILYMED
A36BXO4PPX
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
EPA CompTox
DTXSID00915701
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
CAS
64024-15-3
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
DRUG BANK
DBSALT001009
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
ECHA (EC/EINECS)
264-612-1
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
ChEMBL
CHEMBL560
Created by admin on Fri Dec 15 16:00:06 UTC 2023 , Edited by admin on Fri Dec 15 16:00:06 UTC 2023
PRIMARY
Related Record Type Details
Structure of PENTAZOCINE
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of PENTAZOCINE
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966