U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 MALONYLGENISTIN

SMILES

O[C@@H]1[C@@H](COC(=O)CC(O)=O)O[C@@H](OC2=CC(O)=C3C(=O)C(=COC3=C2)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

Approval Year

Name Type Language
MALONYLGENISTIN
Common 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
6''-O-MALONYLGENISTIN
Common Name English
Code System Code Type Description
FDA UNII
2AUB85VT2K
Created by admin on Sat Dec 16 11:22:14 GMT 2023 , Edited by admin on Sat Dec 16 11:22:14 GMT 2023
PRIMARY
PUBCHEM
15934091
Created by admin on Sat Dec 16 11:22:14 GMT 2023 , Edited by admin on Sat Dec 16 11:22:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID201316854
Created by admin on Sat Dec 16 11:22:14 GMT 2023 , Edited by admin on Sat Dec 16 11:22:14 GMT 2023
PRIMARY
CHEBI
80372
Created by admin on Sat Dec 16 11:22:14 GMT 2023 , Edited by admin on Sat Dec 16 11:22:14 GMT 2023
PRIMARY
CAS
51011-05-3
Created by admin on Sat Dec 16 11:22:14 GMT 2023 , Edited by admin on Sat Dec 16 11:22:14 GMT 2023
PRIMARY