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CHEBI:3250 - Byakangelicin

ChEBI IDCHEBI:3250
ChEBI NameByakangelicin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H18O7
Net Charge0
Average Mass334.324
Monoisotopic Mass334.10525
SMILESCOc1c2ccoc2c(OC[C@@H](O)C(C)(C)O)c2oc(=O)ccc12
InChIInChI=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
InChIKeyPKRPFNXROFUNDE-LLVKDONJSA-N
ChEBI Ontology
Outgoing Relation(s)
Byakangelicin (CHEBI:3250) is a psoralens (CHEBI:26369)
Synonym  Source
ByakangelicinKEGG COMPOUND
Manual XrefsDatabases
C09141KEGG COMPOUND
C00002453KNApSAcK
Registry NumbersSources
CAS:482-25-7KEGG COMPOUND