CHEBI:3572 - Chalepensin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Chalepensin
ChEBI ID CHEBI:3572
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C16H14O3
C16H14O3
Net Charge 0
Average Mass 254.281
Monoisotopic Mass 254.09429
InChI InChI=1S/C16H14O3/c1-4-16(2,3)12-8-11-7-10-5-6-18-13(10)9-14(11)19-15(12)17/h4-9H,1H2,2-3H3
InChIKey FYCCCUNGXGKNJV-UHFFFAOYSA-N
SMILES CC(C)(C=C)c1cc2cc3ccoc3cc2oc1=O
ChEBI Ontology
Outgoing Chalepensin (CHEBI:3572) is a furanocoumarin (CHEBI:24128)
Synonyms Sources
3-(alpha,alpha-Dimethylallyl)psoralen KEGG COMPOUND
Chalepensin KEGG COMPOUND
Manual Xrefs Databases
C00002456 KNApSAcK
C09165 KEGG COMPOUND
LSM-20688 LINCS
View more database links
Registry Number Type Source
13164-03-9 CAS Registry Number KEGG COMPOUND
Last Modified
25 February 2016