MALONYLGENISTIN

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 Search

SMILES

O[C@@H]1[C@@H](COC(=O)CC(O)=O)O[C@@H](OC2=CC3=C(C(O)=C2)C(=O)C(=CO3)C4=CC=C(O)C=C4)[C@H](O)[C@H]1O

InChI

InChIKey=FRAUJUKWSKMNJY-RSEYPYQYSA-N

InChI=1S/C24H22O13/c25-11-3-1-10(2-4-11)13-8-34-15-6-12(5-14(26)19(15)20(13)30)36-24-23(33)22(32)21(31)16(37-24)9-35-18(29)7-17(27)28/h1-6,8,16,21-26,31-33H,7,9H2,(H,27,28)/t16-,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 16:22:27 GMT 2025` Edited by `admin` on `Tue Apr 01 16:22:27 GMT 2025`
Record UNII	2AUB85VT2K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MALONYLGENISTIN

Common Name

English

6''-O-MALONYLGENISTIN

Preferred Name

English

7-O-GLUCOSYL-6''-MALONYL GENISTEIN

Common Name

English

GENISTIN MALONATE

Common Name

English

GENISTIN 6''-O-MALONATE

Common Name

English

5-HYDROXY-3-(4-HYDROXYPHENYL)-4-OXO-4H-CHROMEN-7-YL 6-O-(CARBOXYLATOACETYL)HEXOPYRANOSIDE

Systematic Name

English

MALONYL GENISTIN (CONSTITUENT OF SOY ISOFLAVONES) [DSC]

Common Name

English

GENISTEIN-7-O-.BETA.-D-GLUCOSYL-6''-O-MALONATE

Common Name

English

PROPANEDIOIC ACID, 6'-ESTER WITH 7-(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-3-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE

Common Name

English

Code System Code Type Description

FDA UNII

2AUB85VT2K