APIGENIN 7-O-(6-O-MALONYLGLUCOSIDE)

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H22O13
Molecular Weight	518.4237
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of APIGENIN 7-O-(6-O-MALONYLGLUCOSIDE)

Structure Search

SMILES

O[C@@H]1[C@@H](COC(=O)CC(O)=O)O[C@@H](OC2=CC3=C(C(=O)C=C(O3)C4=CC=C(O)C=C4)C(O)=C2)[C@H](O)[C@H]1O

InChI

InChIKey=JXWAQRJFONLTSI-ASDZUOGYSA-N

InChI=1S/C24H22O13/c25-11-3-1-10(2-4-11)15-7-14(27)20-13(26)5-12(6-16(20)36-15)35-24-23(33)22(32)21(31)17(37-24)9-34-19(30)8-18(28)29/h1-7,17,21-26,31-33H,8-9H2,(H,28,29)/t17-,21-,22+,23-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H22O13
Molecular Weight	518.4237
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 `Tue Apr 01 18:36:45 GMT 2025` Edited by `admin` on `Tue Apr 01 18:36:45 GMT 2025`
Record UNII	AOF5Z3UWMW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4H-1-BENZOPYRAN-4-ONE, 7-((6-O-(CARBOXYACETYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5-HYDROXY-2-(4-HYDROXYPHENYL)-

Preferred Name

English

APIGENIN 7-O-(6-O-MALONYLGLUCOSIDE)

Common Name

English

APIGENIN 7-O-(6''-MALONYL)-.BETA.-D-GLUCOPYRANOSIDE

Systematic Name

English

7-((6-O-(CARBOXYACETYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5-HYDROXY-2-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE

Systematic Name

English

PROPANEDIOIC ACID, 6'-ESTER WITH 7-(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-2-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE

Systematic Name

English

APIGENIN 7-O-MALONYLGLUCOSIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

AOF5Z3UWMW

Created by admin on Tue Apr 01 18:36:45 GMT 2025 , Edited by admin on Tue Apr 01 18:36:45 GMT 2025

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PUBCHEM

5281602

Created by admin on Tue Apr 01 18:36:45 GMT 2025 , Edited by admin on Tue Apr 01 18:36:45 GMT 2025

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EPA CompTox

DTXSID00235658

Created by admin on Tue Apr 01 18:36:45 GMT 2025 , Edited by admin on Tue Apr 01 18:36:45 GMT 2025

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CAS

86546-87-4

Created by admin on Tue Apr 01 18:36:45 GMT 2025 , Edited by admin on Tue Apr 01 18:36:45 GMT 2025

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