AJMALINE MONOETHANOLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H26N2O2.C2H6O
Molecular Weight	372.5011
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCO.[H][C@@]12N(C)C3=C(C=CC=C3)[C@]14C[C@H]5[C@@H]([C@H]4O)[C@@]6([H])C[C@]2([H])N5[C@H](O)[C@H]6CC

InChI

InChIKey=ASXHFVPFQMMNNZ-LCJCZRDQSA-N

InChI=1S/C20H26N2O2.C2H6O/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24;1-2-3/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3;3H,2H2,1H3/t10-,11-,14-,15-,16-,17-,18+,19+,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C20H26N2O2
Molecular Weight	326.4326
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C2H6O
Molecular Weight	46.0684
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 08:37:21 UTC 2023` Edited by `admin` on `Sat Dec 16 08:37:21 UTC 2023`
Record UNII	QT1U5T329Q
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

AJMALINE MONOETHANOLATE

Common Name

English

ETHANOL, COMPD. WITH (17R,21.ALPHA.)-AJMALAN-17,21-DIOL (1:1)

Common Name

English

Ajmaline monoethanolate [WHO-DD]

Common Name

English

AJMALAN-17,21-DIOL, (17R,21.ALPHA.)-, COMPD. WITH ETHANOL (1:1)

Systematic Name

English

Code System Code Type Description

SMS_ID

100000077966