VORINOSTAT-O-GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28N2O9
Molecular Weight	440.4443
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@@H]1[C@@H](O)[C@H](ONC(=O)CCCCCCC(=O)NC2=CC=CC=C2)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=AGXZHORDQQELAH-JNIAIEOXSA-N

InChI=1S/C20H28N2O9/c23-13(21-12-8-4-3-5-9-12)10-6-1-2-7-11-14(24)22-31-20-17(27)15(25)16(26)18(30-20)19(28)29/h3-5,8-9,15-18,20,25-27H,1-2,6-7,10-11H2,(H,21,23)(H,22,24)(H,28,29)/t15-,16-,17+,18-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H28N2O9
Molecular Weight	440.4443
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:05:18 GMT 2025` Edited by `admin` on `Mon Mar 31 21:05:18 GMT 2025`
Record UNII	8031213WQ4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VORINOSTAT-O-GLUCURONIDE

Common Name

English

SUBEROYLANILIDE HYDROXAMIC ACID .BETA.-D-GLUCURONIDE

Preferred Name

English

L001302381

Code

English

.BETA.-D-GLUCOPYRANURONIC ACID, 1-O-((1,8-DIOXO-8-(PHENYLAMINO)OCTYL)AMINO)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

44425383

Created by admin on Mon Mar 31 21:05:18 GMT 2025 , Edited by admin on Mon Mar 31 21:05:18 GMT 2025

PRIMARY

CAS

863456-50-2

Created by admin on Mon Mar 31 21:05:18 GMT 2025 , Edited by admin on Mon Mar 31 21:05:18 GMT 2025

PRIMARY

FDA UNII

8031213WQ4

Created by admin on Mon Mar 31 21:05:18 GMT 2025 , Edited by admin on Mon Mar 31 21:05:18 GMT 2025

PRIMARY

Related Record Type Details


					58IFB293JI

VORINOSTAT

PARENT -> METABOLITE INACTIVE

Qualification:

URINE

Amount: