HYDRODOLASETRON

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H22N2O3
Molecular Weight	326.3896
Optical Activity	( + / - )
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])C[C@@H](C[C@]([H])(C1)N3CC2O)OC(=O)C4=CNC5=C4C=CC=C5

InChI

InChIKey=MLWGAEVSWJXOQJ-ROFJUSHLSA-N

InChI=1S/C19H22N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,18,20,22H,5-8,10H2/t11-,12-,13+,14+,18?

HIDE SMILES / InChI

Molecular Formula	C19H22N2O3
Molecular Weight	326.3896
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:16:56 UTC 2023` Edited by `admin` on `Fri Dec 15 20:16:56 UTC 2023`
Record UNII	YC09CA0VBB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HYDRODOLASETRON

Common Name

English

REDUCED DOLASETRON

Common Name

English

1H-INDOLE-3-CARBOXYLIC ACID, OCTAHYDRO-3-HYDROXY-2,6-METHANO-2H-QUINOLIZIN-8-YL ESTER

Common Name

English

MDL-74156

Code

English

MDL 74156

Code

English

Code System Code Type Description

FDA UNII

YC09CA0VBB

Created by admin on Fri Dec 15 20:16:56 UTC 2023 , Edited by admin on Fri Dec 15 20:16:56 UTC 2023

PRIMARY

CAS

127951-99-9

Created by admin on Fri Dec 15 20:16:56 UTC 2023 , Edited by admin on Fri Dec 15 20:16:56 UTC 2023

PRIMARY

EPA CompTox

DTXSID90926043

Created by admin on Fri Dec 15 20:16:56 UTC 2023 , Edited by admin on Fri Dec 15 20:16:56 UTC 2023

PRIMARY

Related Record Type Details


					82WI2L7Q6E

DOLASETRON

PARENT -> METABOLITE ACTIVE

Amount: