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CHEBI:206343 - Nambinone A

ChEBI IDCHEBI:206343
ChEBI NameNambinone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC[C@H]1CC[C@@H](O)C2=CC(=O)[C@H]3[C@H]([C@@]3(C)CO)[C@@]21C
InChIInChI=1S/C15H22O3/c1-8-4-5-10(17)9-6-11(18)12-13(15(8,9)3)14(12,2)7-16/h6,8,10,12-13,16-17H,4-5,7H2,1-3H3/t8-,10+,12-,13+,14-,15+/m0/s1
InChIKeyOXMLIAHQTBPUGH-BFDUEXLHSA-N
Species of MetaboliteComponentSourceComments
Neonothopanus nambi (ncbitaxon:71958) - DOI (10.1016/j.tet.2012.07.057)
ChEBI Ontology
Outgoing Relation(s)
Nambinone A (CHEBI:206343) has parent hydride aristolane (CHEBI:35784)
Nambinone A (CHEBI:206343) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,1aS,4R,7S,7aS,7bS)-4-hydroxy-1-(hydroxymethyl)-1,7,7a-trimethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one