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CHEBI:81275 - Lappaol C

ChEBI IDCHEBI:81275
ChEBI NameLappaol C
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DownloadsMolfile
FormulaC30H34O10
Net Charge0
Average Mass554.592
Monoisotopic Mass554.21520
SMILESCOc1cc(C[C@H]2C(=O)OC[C@@H]2Cc2cc(OC)c(O)c(C(CO)C(O)c3ccc(O)c(OC)c3)c2)ccc1O
InChIInChI=1S/C30H34O10/c1-37-25-11-16(4-6-23(25)32)9-20-19(15-40-30(20)36)8-17-10-21(29(35)27(12-17)39-3)22(14-31)28(34)18-5-7-24(33)26(13-18)38-2/h4-7,10-13,19-20,22,28,31-35H,8-9,14-15H2,1-3H3/t19-,20+,22?,28?/m0/s1
InChIKeyBWOAMGHNXHLWMX-BAOMQRJLSA-N
ChEBI Ontology
Outgoing Relation(s)
Lappaol C (CHEBI:81275) is a lignan (CHEBI:25036)
Manual XrefsDatabases
C17686KEGG COMPOUND