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CHEBI:80873 - Nigakilactone F

Default Structure
ChEBI IDCHEBI:80873
ChEBI NameNigakilactone F
Stars
DownloadsMolfile
FormulaC22H32O7
Net Charge0
Average Mass408.491
Monoisotopic Mass408.21480
SMILES[H][C@]12CC(=O)O[C@]3([H])C[C@@]4([H])[C@H](C)C=C(OC)C(=O)[C@]4(C)[C@@]([H])([C@H](O)[C@@H](OC)[C@@]1(C)O)[C@]23C
InChIInChI=1S/C22H32O7/c1-10-7-12(27-5)18(25)20(2)11(10)8-14-21(3)13(9-15(23)29-14)22(4,26)19(28-6)16(24)17(20)21/h7,10-11,13-14,16-17,19,24,26H,8-9H2,1-6H3/t10-,11+,13-,14-,16+,17-,19-,20+,21-,22+/m1/s1
InChIKeyOFOPXAFBCZQTFU-KOEFXMDHSA-N
ChEBI Ontology
Outgoing Relation(s)
Nigakilactone F (CHEBI:80873) is a triterpenoid (CHEBI:36615)
Manual XrefsDatabases
C17031KEGG COMPOUND
Registry NumbersSources
CAS:28387-43-1KEGG COMPOUND