CHEBI:81136 - Notopterol

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ChEBI Name Notopterol
ChEBI ID CHEBI:81136
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H22O5
Net Charge 0
Average Mass 354.39640
Monoisotopic Mass 354.14672
InChI InChI=1S/C21H22O5/c1-13(2)10-15(22)11-14(3)6-8-25-21-16-4-5-20(23)26-19(16)12-18-17(21)7-9-24-18/h4-7,9-10,12,15,22H,8,11H2,1-3H3/b14-6+
InChIKey BKIACVAZUKISOR-MKMNVTDBSA-N
SMILES CC(C)=CC(O)C\C(C)=C\COc1c2ccoc2cc2oc(=O)ccc12
ChEBI Ontology
Outgoing Notopterol (CHEBI:81136) is a furanocoumarin (CHEBI:24128)
Manual Xref Database
C17499 KEGG COMPOUND
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Registry Number Type Source
88206-46-6 CAS Registry Number KEGG COMPOUND