CHEBI:8213 - Pimpinellin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pimpinellin
ChEBI ID CHEBI:8213
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C13H10O5
C13H10O5
Net Charge 0
Average Mass 246.216
Monoisotopic Mass 246.05282
InChI InChI=1S/C13H10O5/c1-15-11-7-3-4-9(14)18-10(7)8-5-6-17-12(8)13(11)16-2/h3-6H,1-2H3
InChIKey BQPRWZCEKZLBHL-UHFFFAOYSA-N
SMILES COc1c(OC)c2ccc(=O)oc2c2ccoc12
ChEBI Ontology
Outgoing Pimpinellin (CHEBI:8213) is a furanocoumarin (CHEBI:24128)
Synonym Source
Pimpinellin KEGG COMPOUND
Manual Xrefs Databases
C00002493 KNApSAcK
C09285 KEGG COMPOUND
LSM-24980 LINCS
View more database links
Registry Number Type Source
131-12-4 CAS Registry Number KEGG COMPOUND
Last Modified
25 February 2016