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CHEBI:80877 - Nigakilactone M

Default Structure
ChEBI IDCHEBI:80877
ChEBI NameNigakilactone M
Stars
DownloadsMolfile
FormulaC21H30O7
Net Charge0
Average Mass394.464
Monoisotopic Mass394.19915
SMILES[H][C@@]12[C@H](O)[C@@H](O)[C@H](C)[C@]3(O)CC(=O)O[C@]([H])(C[C@@]4([H])[C@H](C)C=C(OC)C(=O)[C@]14C)[C@]23C
InChIInChI=1S/C21H30O7/c1-9-6-12(27-5)18(25)19(3)11(9)7-13-20(4)17(19)16(24)15(23)10(2)21(20,26)8-14(22)28-13/h6,9-11,13,15-17,23-24,26H,7-8H2,1-5H3/t9-,10+,11+,13-,15+,16-,17-,19+,20-,21-/m1/s1
InChIKeyJTUXCVKEZIPSKW-WMJZPHELSA-N
ChEBI Ontology
Outgoing Relation(s)
Nigakilactone M (CHEBI:80877) is a triterpenoid (CHEBI:36615)
Manual XrefsDatabases
C17035KEGG COMPOUND