CHEBI:3250 - Byakangelicin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Byakangelicin
ChEBI ID CHEBI:3250
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H18O7
Net Charge 0
Average Mass 334.321
Monoisotopic Mass 334.10525
InChI InChI=1S/C17H18O7/c1-17(2,20)11(18)8-23-16-14-10(6-7-22-14)13(21-3)9-4-5-12(19)24-15(9)16/h4-7,11,18,20H,8H2,1-3H3/t11-/m1/s1
InChIKey PKRPFNXROFUNDE-LLVKDONJSA-N
SMILES COc1c2ccoc2c(OC[C@@H](O)C(C)(C)O)c2oc(=O)ccc12
ChEBI Ontology
Outgoing Byakangelicin (CHEBI:3250) is a psoralens (CHEBI:26369)
Synonym Source
Byakangelicin KEGG COMPOUND
Manual Xrefs Databases
C00002453 KNApSAcK
C09141 KEGG COMPOUND
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Registry Number Type Source
482-25-7 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014