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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18O8
Molecular Weight 398.3628
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(ACETYLOXY)-3-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-4H-CHROMEN-7-YL ACETATE

SMILES

COC1=CC=C(C=C1)C2=C(OC)C(=O)C3=C(O2)C=C(OC(C)=O)C=C3OC(C)=O

InChI

InChIKey=OXRCQEMNONCHMK-UHFFFAOYSA-N
InChI=1S/C21H18O8/c1-11(22)27-15-9-16(28-12(2)23)18-17(10-15)29-20(21(26-4)19(18)24)13-5-7-14(25-3)8-6-13/h5-10H,1-4H3

HIDE SMILES / InChI

Molecular Formula C21H18O8
Molecular Weight 398.3628
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 Tue Apr 01 19:51:17 GMT 2025
Edited
by admin
on Tue Apr 01 19:51:17 GMT 2025
Record UNII
925XMG2J33
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-31884
Preferred Name English
5-(ACETYLOXY)-3-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-4H-CHROMEN-7-YL ACETATE
Systematic Name English
5,7-BIS(ACETYLOXY)-3-METHOXY-2-(4-METHOXYPHENYL)-4H-1-BENZOPYRAN-4-ONE
Systematic Name English
4H-1-BENZOPYRAN-4-ONE, 5,7-BIS(ACETYLOXY)-3-METHOXY-2-(4-METHOXYPHENYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
925XMG2J33
Created by admin on Tue Apr 01 19:51:17 GMT 2025 , Edited by admin on Tue Apr 01 19:51:17 GMT 2025
PRIMARY
EPA CompTox
DTXSID00212565
Created by admin on Tue Apr 01 19:51:17 GMT 2025 , Edited by admin on Tue Apr 01 19:51:17 GMT 2025
PRIMARY
CAS
6320-37-2
Created by admin on Tue Apr 01 19:51:17 GMT 2025 , Edited by admin on Tue Apr 01 19:51:17 GMT 2025
PRIMARY
NSC
31884
Created by admin on Tue Apr 01 19:51:17 GMT 2025 , Edited by admin on Tue Apr 01 19:51:17 GMT 2025
PRIMARY
PUBCHEM
233390
Created by admin on Tue Apr 01 19:51:17 GMT 2025 , Edited by admin on Tue Apr 01 19:51:17 GMT 2025
PRIMARY