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Details

Stereochemistry ACHIRAL
Molecular Formula C16H12O6
Molecular Weight 300.2629
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAJANIN

SMILES

COC1=CC2=C(C(=O)C(=CO2)C3=CC=C(O)C=C3O)C(O)=C1

InChI

InChIKey=ALFNTRJPGFNJQV-UHFFFAOYSA-N
InChI=1S/C16H12O6/c1-21-9-5-13(19)15-14(6-9)22-7-11(16(15)20)10-3-2-8(17)4-12(10)18/h2-7,17-19H,1H3

HIDE SMILES / InChI

Molecular Formula C16H12O6
Molecular Weight 300.2629
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:09:18 GMT 2025
Edited
by admin
on Mon Mar 31 19:09:18 GMT 2025
Record UNII
F3QGE5M9QS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOFLAVONE, 2',4',5-TRIHYDROXY-7-METHOXY-
Preferred Name English
CAJANIN
Common Name English
4H-1-BENZOPYRAN-4-ONE, 3-(2,4-DIHYDROXYPHENYL)-5-HYDROXY-7-METHOXY-
Systematic Name English
3-(2,4-DIHYDROXYPHENYL)-5-HYDROXY-7-METHOXY-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
F3QGE5M9QS
Created by admin on Mon Mar 31 19:09:18 GMT 2025 , Edited by admin on Mon Mar 31 19:09:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID10954540
Created by admin on Mon Mar 31 19:09:18 GMT 2025 , Edited by admin on Mon Mar 31 19:09:18 GMT 2025
PRIMARY
PUBCHEM
5281706
Created by admin on Mon Mar 31 19:09:18 GMT 2025 , Edited by admin on Mon Mar 31 19:09:18 GMT 2025
PRIMARY
CAS
32884-36-9
Created by admin on Mon Mar 31 19:09:18 GMT 2025 , Edited by admin on Mon Mar 31 19:09:18 GMT 2025
PRIMARY