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Details

Stereochemistry ACHIRAL
Molecular Formula C19H12O6
Molecular Weight 336.295
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(6-METHOXY-1,3-BENZODIOXOL-5-YL)-7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE

SMILES

COC1=CC2=C(OCO2)C=C1C3=CC4=C(OC3=O)C=C5OC=CC5=C4

InChI

InChIKey=PENSQRMNZZWMGV-UHFFFAOYSA-N
InChI=1S/C19H12O6/c1-21-16-8-18-17(23-9-24-18)6-12(16)13-5-11-4-10-2-3-22-14(10)7-15(11)25-19(13)20/h2-8H,9H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H12O6
Molecular Weight 336.295
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 19:33:28 GMT 2025
Edited
by admin
on Tue Apr 01 19:33:28 GMT 2025
Record UNII
3F597EPM0S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-404570
Preferred Name English
6-(6-METHOXY-1,3-BENZODIOXOL-5-YL)-7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE
Systematic Name English
PACHYRRHIZIN
Common Name English
5-BENZOFURANACRYLIC ACID, 6-HYDROXY-.ALPHA.-(2-METHOXY-4,5-(METHYLENEDIOXY)PHENYL)-, .DELTA.-LACTONE
Systematic Name English
7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 6-(6-METHOXY-1,3-BENZODIOXOL-5-YL)-
Systematic Name English
NEORAUTONE
Common Name English
PACHYRRHIZIN (PACHYRHIZUS)
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID10143573
Created by admin on Tue Apr 01 19:33:28 GMT 2025 , Edited by admin on Tue Apr 01 19:33:28 GMT 2025
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NSC
404570
Created by admin on Tue Apr 01 19:33:28 GMT 2025 , Edited by admin on Tue Apr 01 19:33:28 GMT 2025
PRIMARY
PUBCHEM
101277
Created by admin on Tue Apr 01 19:33:28 GMT 2025 , Edited by admin on Tue Apr 01 19:33:28 GMT 2025
PRIMARY
FDA UNII
3F597EPM0S
Created by admin on Tue Apr 01 19:33:28 GMT 2025 , Edited by admin on Tue Apr 01 19:33:28 GMT 2025
PRIMARY
CAS
10091-01-7
Created by admin on Tue Apr 01 19:33:28 GMT 2025 , Edited by admin on Tue Apr 01 19:33:28 GMT 2025
PRIMARY