CHEBI:175277 - Phaseol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Phaseol
ChEBI ID CHEBI:175277
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H16O5
Net Charge 0
Average Mass 336.343
Monoisotopic Mass 336.09977
InChI InChI=1S/C20H16O5/c1-10(2)3-5-12-15(22)8-7-14-18(12)25-20(23)17-13-6-4-11(21)9-16(13)24-19(14)17/h3-4,6-9,21-22H,5H2,1-2H3
InChIKey FRXPSBUCIWPZMH-UHFFFAOYSA-N
SMILES O1C=2C3=C(OC(=O)C2C4=C1C=C(O)C=C4)C(CC=C(C)C)=C(O)C=C3
ChEBI Ontology
Outgoing Phaseol (CHEBI:175277) is a coumestans (CHEBI:72577)
IUPAC Name
3,9-dihydroxy-4-(3-methylbut-2-enyl)-[1]benzouro[3,2-c]chromen-6-one
Manual Xrefs Databases
24843105 ChemSpider
C05229 KEGG COMPOUND
HMDB0037922 HMDB
LMPK12090010 LIPID MAPS
PHASEOLLIDIN-HYDRATE MetaCyc
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