(2S,3S,4S,5R,6S)-6-(3-CYANO-4-HYDROXY-BENZOYL)OXY-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1OC(=O)C2=CC=C(O)C(=C2)C#N)C(O)=O

InChIKey=BJBWHHBHQLSETH-JVWRJRKNSA-N

InChI=1S/C14H13NO9/c15-4-6-3-5(1-2-7(6)16)13(22)24-14-10(19)8(17)9(18)11(23-14)12(20)21/h1-3,8-11,14,16-19H,(H,20,21)/t8-,9-,10+,11-,14-/m0/s1

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

Substance Class	Chemical Created by `admin` on `Wed Apr 02 07:33:13 GMT 2025` Edited by `admin` on `Wed Apr 02 07:33:13 GMT 2025`
Record UNII	500G9F4FG8
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

OZANIMOD METABOLITE M339

Preferred Name

English

(2S,3S,4S,5R,6S)-6-(3-CYANO-4-HYDROXY-BENZOYL)OXY-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

154584876

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

FDA UNII

500G9F4FG8

Created by admin on Wed Apr 02 07:33:13 GMT 2025 , Edited by admin on Wed Apr 02 07:33:13 GMT 2025

PRIMARY

Related Record Type Details


					Z80293URPV

Ozanimod

PARENT -> METABOLITE INACTIVE

Qualification:

URINE