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

Details

Stereochemistry RACEMIC
Molecular Formula C16H14O5
Molecular Weight 286.2794
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OXYPEUCEDANIN, (±)-

SMILES

CC1(C)OC1COC2=C3C=COC3=CC4=C2C=CC(=O)O4

InChI

InChIKey=QTAGQHZOLRFCBU-UHFFFAOYSA-N
InChI=1S/C16H14O5/c1-16(2)13(21-16)8-19-15-9-3-4-14(17)20-12(9)7-11-10(15)5-6-18-11/h3-7,13H,8H2,1-2H3

HIDE SMILES / InChI

Approval Year