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CHEBI:2808 - Archangelicin

ChEBI IDCHEBI:2808
ChEBI NameArchangelicin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC24H26O7
Net Charge0
Average Mass426.465
Monoisotopic Mass426.16785
SMILESC/C=C(\C)C(=O)OC(C)(C)C1Oc2ccc3ccc(=O)oc3c2[C@H]1OC(=O)C=C(C)C
InChIInChI=1S/C24H26O7/c1-7-14(4)23(27)31-24(5,6)22-21(30-18(26)12-13(2)3)19-16(28-22)10-8-15-9-11-17(25)29-20(15)19/h7-12,21-22H,1-6H3/b14-7+/t21-,22?/m1/s1
InChIKeyCRQDVOOXGMAUAP-WSRXYXLGSA-N
ChEBI Ontology
Outgoing Relation(s)
Archangelicin (CHEBI:2808) is a furanocoumarin (CHEBI:24128)
Synonym  Source
ArchangelicinKEGG COMPOUND
Manual XrefsDatabases
C09116KEGG COMPOUND
C00002451KNApSAcK
Registry NumbersSources
CAS:2607-56-9KEGG COMPOUND