GEMAZOCINE

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H29NO
Molecular Weight	299.4504
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@]12CCN(CC3CC3)[C@H](CC4=CC=C(O)C=C14)C2(C)C

InChI

InChIKey=AFZOCGNTFCGOEE-QUCCMNQESA-N

InChI=1S/C20H29NO/c1-4-20-9-10-21(13-14-5-6-14)18(19(20,2)3)11-15-7-8-16(22)12-17(15)20/h7-8,12,14,18,22H,4-6,9-11,13H2,1-3H3/t18-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H29NO
Molecular Weight	299.4504
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://scripts.iucr.org/cgi-bin/paper?a17358 | https://scripts.iucr.org/cgi-bin/paper?a22853
Curator's Comment: R 15497 (Janssen) mentioned here: https://books.google.com/books?id=bewpAQAAMAAJ&pg=PA153&lpg=PA153&dq=R-15497+antagonist&source=bl&ots=iUJTjWLAxl&sig=ACfU3U1oANmr-88qT12DktnO1wCY-8W2lg&hl=en&sa=X&ved=2ahUKEwiizt2Az_jiAhXYop4KHWgxBAEQ6AEwAXoECAgQAQ#v=onepage&q=R-15497%20antagonist&f=false

Gemazocine is an opioid antagonist. It was first reported in the literature in the 1970’s, and toxicology studies have been performed to characterize its profile.

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:37:23 GMT 2025` Edited by `admin` on `Mon Mar 31 18:37:23 GMT 2025`
Record UNII	V1A2S0LB62
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GEMAZOCINE

Official Name

English

3-(CYCLOPROPYLMETHYL)-6-ETHYL-1,2,3,4,5,6-HEXAHYDRO-11,11-DIMETHYL-2,6-METHANO-3-BENZAZOCIN-8-OL

Preferred Name

English

gemazocine [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C681