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CHEBI:215888 - Hawaiinolide A

ChEBI IDCHEBI:215888
ChEBI NameHawaiinolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O4
Net Charge0
Average Mass330.424
Monoisotopic Mass330.18311
SMILESC=C[C@@H]1C(=C)CC[C@H]2[C@H]1CC(=O)[C@@]1(O)[C@@]3(C)C(=O)O[C@H]3CC[C@]21C
InChIInChI=1S/C20H26O4/c1-5-12-11(2)6-7-14-13(12)10-15(21)20(23)18(14,3)9-8-16-19(20,4)17(22)24-16/h5,12-14,16,23H,1-2,6-10H2,3-4H3/t12-,13+,14+,16+,18-,19-,20+/m1/s1
InChIKeyRIIIZSAGFOLSAE-XTIVUVSQSA-N
Species of MetaboliteComponentSourceComments
Paracamarosporium hawaiiense (ncbitaxon:502129) - PubMed (24882446)
ChEBI Ontology
Outgoing Relation(s)
Hawaiinolide A (CHEBI:215888) is a steroid lactone (CHEBI:26766)
IUPAC Name 
(1R,2S,6S,7R,10S,11S,14S)-6-ethenyl-10-hydroxy-1,11-dimethyl-5-methylidene-13-oxatetracyclo[8.6.0.02,7.011,14]hexadecane-9,12-dione
Manual XrefsDatabases
34247849ChemSpider