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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H6O3
Molecular Weight 186.1635
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAKUCHICIN

SMILES

O=C1OC2=C(C=C1)C3=C(C=CO3)C=C2

InChI

InChIKey=HMUJHZNYHJMOHR-UHFFFAOYSA-N
InChI=1S/C11H6O3/c12-10-4-2-8-9(14-10)3-1-7-5-6-13-11(7)8/h1-6H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
ALLOPSORALEN
Preferred Name English
BAKUCHICIN
Common Name English
2-PROPENOIC ACID, 3-(6-HYDROXY-7-BENZOFURANYL)-, .DELTA.-LACTONE
Systematic Name English
7H-FURO(2,3-F)(1)BENZOPYRAN-7-ONE
Systematic Name English
Code System Code Type Description
CAS
4412-93-5
Created by admin on Tue Apr 01 22:20:03 GMT 2025 , Edited by admin on Tue Apr 01 22:20:03 GMT 2025
PRIMARY
FDA UNII
79Z8P9F2HJ
Created by admin on Tue Apr 01 22:20:03 GMT 2025 , Edited by admin on Tue Apr 01 22:20:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID30196046
Created by admin on Tue Apr 01 22:20:03 GMT 2025 , Edited by admin on Tue Apr 01 22:20:03 GMT 2025
PRIMARY
PUBCHEM
3083848
Created by admin on Tue Apr 01 22:20:03 GMT 2025 , Edited by admin on Tue Apr 01 22:20:03 GMT 2025
PRIMARY
SUBSTANCE RECORD
Structure of BAKUCHICIN
NIH
NCATS
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