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CHEBI:202965 - Colletobredin C

ChEBI IDCHEBI:202965
ChEBI NameColletobredin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O8
Net Charge0
Average Mass426.506
Monoisotopic Mass426.22537
SMILESCCCCC[C@H]1Cc2c(C)c(O)c(C)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2CO1
InChIInChI=1S/C22H34O8/c1-4-5-6-7-13-8-14-11(2)17(24)12(3)21(15(14)10-28-13)30-22-20(27)19(26)18(25)16(9-23)29-22/h13,16,18-20,22-27H,4-10H2,1-3H3/t13-,16+,18+,19-,20+,22-/m0/s1
InChIKeyXUKJWPXLCBGIPO-AZAWAHRISA-N
Species of MetaboliteComponentSourceComments
Colletotrichum (ncbitaxon:5455) - PubMed (26182330)
ChEBI Ontology
Outgoing Relation(s)
Colletobredin C (CHEBI:202965) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[[(3S)-6-hydroxy-5,7-dimethyl-3-pentyl-3,4-dihydro-1H-isochromen-8-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
78440922ChemSpider