CHEBI:81139 - Cnidilin

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ChEBI Name Cnidilin
ChEBI ID CHEBI:81139
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H16O5
Net Charge 0
Average Mass 300.30590
Monoisotopic Mass 300.09977
InChI InChI=1S/C17H16O5/c1-10(2)6-8-20-14-11-4-5-13(18)22-16(11)17(19-3)15-12(14)7-9-21-15/h4-7,9H,8H2,1-3H3
InChIKey NNDOCYLWULORAM-UHFFFAOYSA-N
SMILES COc1c2occc2c(OCC=C(C)C)c2ccc(=O)oc12
ChEBI Ontology
Outgoing Cnidilin (CHEBI:81139) is a psoralens (CHEBI:26369)
Synonym Source
Isophellopterin KEGG COMPOUND
Manual Xref Database
C17503 KEGG COMPOUND
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