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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12O3
Molecular Weight 180.2005
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PYRENOLIDE B

SMILES

C[C@@H]1CC\C=C\C(=O)C=CC(=O)O1

InChI

InChIKey=WMGURONUQLCIRS-QLGZBTQXSA-N
InChI=1S/C10H12O3/c1-8-4-2-3-5-9(11)6-7-10(12)13-8/h3,5-8H,2,4H2,1H3/b5-3+,7-6-/t8-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
2H-OXECIN-2,5(8H)-DIONE, 9,10-DIHYDRO-10-METHYL-, (3Z,6E,10R)-
Preferred Name English
PYRENOLIDE B
Common Name English
Code System Code Type Description
CAS
76353-68-9
Created by admin on Tue Apr 01 18:29:17 GMT 2025 , Edited by admin on Tue Apr 01 18:29:17 GMT 2025
PRIMARY
PUBCHEM
134975228
Created by admin on Tue Apr 01 18:29:17 GMT 2025 , Edited by admin on Tue Apr 01 18:29:17 GMT 2025
PRIMARY
FDA UNII
96UE55W7FF
Created by admin on Tue Apr 01 18:29:17 GMT 2025 , Edited by admin on Tue Apr 01 18:29:17 GMT 2025
PRIMARY