NEOPINE HYDROBROMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H21NO3.BrH
Molecular Weight	380.276
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Br.COC1=CC=C2C[C@H]3N(C)CC[C@@]45[C@@H](OC1=C24)[C@@H](O)CC=C35

InChI

InChIKey=ALTORFKYYONRLC-VVHLMOBZSA-N

InChI=1S/C18H21NO3.BrH/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;/h3-4,6,12-13,17,20H,5,7-9H2,1-2H3;1H/t12-,13+,17+,18+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C18H21NO3
Molecular Weight	299.3642
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:53:28 GMT 2025` Edited by `admin` on `Mon Mar 31 21:53:28 GMT 2025`
Record UNII	PC9YS1PAII
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NEOPINE HYDROBROMIDE

Common Name

English

NSC-34905

Preferred Name

English

MORPHINAN-6-OL, 8,14-DIDEHYDRO-4,5-EPOXY-3-METHOXY-17-METHYL-, HYDROBROMIDE, (5.ALPHA.,6.ALPHA.)-

Systematic Name

English

NEOPINE HYDROBROMIDE [MI]

Common Name

English

.BETA.-CODEINE HYDROBROMIDE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID90327354