GELSEMINE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H22N2O2.ClH
Molecular Weight	358.862
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[H][C@@]12C[C@H]3OC[C@@H]1[C@@]4([H])N(C)C[C@]2(C=C)[C@@]4([H])[C@@]35C(=O)NC6=CC=CC=C56

InChI

InChIKey=AVNIVHTXRYXBIV-WMTURVKQSA-N

InChI=1S/C20H22N2O2.ClH/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23;/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23);1H/t11-,13+,15+,16+,17-,19-,20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C20H22N2O2
Molecular Weight	322.4009
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:50:15 UTC 2023` Edited by `admin` on `Sat Dec 16 08:50:15 UTC 2023`
Record UNII	82N306UZML
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GELSEMINE HYDROCHLORIDE

Common Name

English

GELSEMINE, MONOHYDROCHLORIDE

Common Name

English

GELSEMINE, HYDROCHLORIDE [HSDB]

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

252-504-7