CHEBI:80871 - Nigakilactone C

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ChEBI Name Nigakilactone C
ChEBI ID CHEBI:80871
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H34O7
Net Charge 0
Average Mass 434.52260
Monoisotopic Mass 434.23045
InChI InChI=1S/C24H34O7/c1-11-8-16(28-6)22(27)24(5)14(11)9-17-23(4)15(10-18(26)31-17)12(2)19(29-7)20(21(23)24)30-13(3)25/h8,11-12,14-15,17,19-21H,9-10H2,1-7H3/t11-,12-,14+,15+,17-,19+,20-,21+,23-,24+/m1/s1
InChIKey JFFUKRBVELYCPJ-FIKFPIMESA-N
SMILES CO[C@H]1[C@H](C)[C@@H]2CC(=O)O[C@@H]3C[C@H]4[C@H](C)C=C(OC)C(=O)[C@]4(C)[C@@H]([C@@H]1OC(C)=O)[C@]23C
ChEBI Ontology
Outgoing Nigakilactone C (CHEBI:80871) is a triterpenoid (CHEBI:36615)
Synonym Source
Quassin KEGG COMPOUND
Manual Xref Database
C17029 KEGG COMPOUND
View more database links
Registry Number Type Source
24148-78-5 CAS Registry Number KEGG COMPOUND