.BETA.-D-GLUCOPYRANURONIC ACID, 1-((4-CHLOROPHENYL)(4-(4-PYRIDINYLCARBONYL)-1-PHTHALAZINYL)AMINO)-1-DEOXY-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H21ClN4O7
Molecular Weight	536.921
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-D-GLUCOPYRANURONIC ACID, 1-((4-CHLOROPHENYL)(4-(4-PYRIDINYLCARBONYL)-1-PHTHALAZINYL)AMINO)-1-DEOXY-

Structure Search

SMILES

O[C@@H]1[C@@H](O)[C@@H](O[C@@H]([C@H]1O)C(O)=O)N(C2=CC=C(Cl)C=C2)C3=C4C=CC=CC4=C(N=N3)C(=O)C5=CC=NC=C5

InChI

InChIKey=CJMGHEKSSLPIAX-LYVDORBWSA-N

InChI=1S/C26H21ClN4O7/c27-14-5-7-15(8-6-14)31(25-22(35)20(33)21(34)23(38-25)26(36)37)24-17-4-2-1-3-16(17)18(29-30-24)19(32)13-9-11-28-12-10-13/h1-12,20-23,25,33-35H,(H,36,37)/t20-,21-,22+,23-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H21ClN4O7
Molecular Weight	536.921
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 `Wed Apr 02 06:55:35 GMT 2025` Edited by `admin` on `Wed Apr 02 06:55:35 GMT 2025`
Record UNII	ND4PG7JUF8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-D-GLUCOPYRANURONIC ACID, 1-((4-CHLOROPHENYL)(4-(4-PYRIDINYLCARBONYL)-1-PHTHALAZINYL)AMINO)-1-DEOXY-

Systematic Name

English

VATALANIB METABOLITE M13

Preferred Name

English

Code System Code Type Description

FDA UNII

ND4PG7JUF8

Created by admin on Wed Apr 02 06:55:35 GMT 2025 , Edited by admin on Wed Apr 02 06:55:35 GMT 2025

PRIMARY

PUBCHEM

156596373

Created by admin on Wed Apr 02 06:55:35 GMT 2025 , Edited by admin on Wed Apr 02 06:55:35 GMT 2025

PRIMARY

CAS

921198-66-5

Created by admin on Wed Apr 02 06:55:35 GMT 2025 , Edited by admin on Wed Apr 02 06:55:35 GMT 2025

PRIMARY

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VATALANIB

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URINE

Amount: