CHEBI:6097 - Kadsurenone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Kadsurenone
ChEBI ID CHEBI:6097
Stars This entity has been manually annotated by a third party.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C21H24O5
Net Charge 0
Average Mass 356.413
Monoisotopic Mass 356.16237
InChI InChI=1S/C21H24O5/c1-6-7-15-12-21(25-5)13(2)20(26-19(21)11-16(15)22)14-8-9-17(23-3)18(10-14)24-4/h6,8-13,20H,1,7H2,2-5H3/t13-,20+,21+/m1/s1
InChIKey VDYACOATPFOZIO-UBWHGVKJSA-N
SMILES COc1ccc(cc1OC)[C@H]1OC2=CC(=O)C(CC=C)=C[C@]2(OC)[C@@H]1C
ChEBI Ontology
Outgoing Kadsurenone (CHEBI:6097) is a benzofurans (CHEBI:35259)
Synonym Source
Kadsurenone KEGG COMPOUND
Manual Xrefs Databases
C00000719 KNApSAcK
C10638 KEGG COMPOUND
View more database links
Registry Number Type Source
95851-37-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014