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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18O6
Molecular Weight 366.364
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DERRUBONE

SMILES

CC(C)=CCC1=C(O)C=C2OC=C(C(=O)C2=C1O)C3=CC=C4OCOC4=C3

InChI

InChIKey=FTBGFGQPUMCUSC-UHFFFAOYSA-N
InChI=1S/C21H18O6/c1-11(2)3-5-13-15(22)8-18-19(20(13)23)21(24)14(9-25-18)12-4-6-16-17(7-12)27-10-26-16/h3-4,6-9,22-23H,5,10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C21H18O6
Molecular Weight 366.364
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 Sat Dec 16 17:24:15 GMT 2023
Edited
by admin
on Sat Dec 16 17:24:15 GMT 2023
Record UNII
EVN8G9T8C6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DERRUBONE
Common Name English
4H-1-Benzopyran-4-one, 3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-6-(3-methyl-2-butenyl)- (
Systematic Name English
ISOFLAVONE, 5,7-DIHYDROXY-6-(3-METHYL-2-BUTENYL)-3',4'-(METHYLENEDIOXY)-
Systematic Name English
3-(1,3-BENZODIOXOL-5-YL)-5,7-DIHYDROXY-6-(3-METHYL-2-BUTEN-1-YL)-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID601027239
Created by admin on Sat Dec 16 17:24:15 GMT 2023 , Edited by admin on Sat Dec 16 17:24:15 GMT 2023
PRIMARY
PUBCHEM
5810067
Created by admin on Sat Dec 16 17:24:15 GMT 2023 , Edited by admin on Sat Dec 16 17:24:15 GMT 2023
PRIMARY
FDA UNII
EVN8G9T8C6
Created by admin on Sat Dec 16 17:24:15 GMT 2023 , Edited by admin on Sat Dec 16 17:24:15 GMT 2023
PRIMARY
CAS
22044-58-2
Created by admin on Sat Dec 16 17:24:15 GMT 2023 , Edited by admin on Sat Dec 16 17:24:15 GMT 2023
PRIMARY
WIKIPEDIA
Derrubone
Created by admin on Sat Dec 16 17:24:15 GMT 2023 , Edited by admin on Sat Dec 16 17:24:15 GMT 2023
PRIMARY