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CHEBI:208486 - Sporochartine A

ChEBI IDCHEBI:208486
ChEBI NameSporochartine A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H34O6
Net Charge0
Average Mass418.530
Monoisotopic Mass418.23554
SMILESCCCCCC[C@H]1OC(=O)[C@@H]2[C@H]1OC(=O)[C@]21CCC=C[C@H]1/C=C/[C@@H]1O[C@H](C)C[C@@H]1O
InChIInChI=1S/C24H34O6/c1-3-4-5-6-10-19-21-20(22(26)29-19)24(23(27)30-21)13-8-7-9-16(24)11-12-18-17(25)14-15(2)28-18/h7,9,11-12,15-21,25H,3-6,8,10,13-14H2,1-2H3/b12-11+/t15-,16+,17+,18+,19-,20+,21+,24+/m1/s1
InChIKeyWDMFLGRPNWGRCQ-RYMDFCTKSA-N
Species of MetaboliteComponentSourceComments
Hypoxylon (ncbitaxon:42308) - PubMed (29043802)
ChEBI Ontology
Outgoing Relation(s)
Sporochartine A (CHEBI:208486) is a C-glycosyl compound (CHEBI:20857)
IUPAC Name 
(3S,3'S,3aS,6R,6aR)-6-hexyl-3'-[(E)-2-[(2S,3S,5R)-3-hydroxy-5-methyloxolan-2-yl]ethenyl]spiro[6,6a-dihydro-3aH-uro[3,4-b]uran-3,4'-cyclohexene]-2,4-dione
Manual XrefsDatabases
62453201ChemSpider