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CHEBI:217511 - Colletofuran D

ChEBI IDCHEBI:217511
ChEBI NameColletofuran D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O7
Net Charge0
Average Mass410.507
Monoisotopic Mass410.23045
SMILESCCCCC[C@@H](O)[C@@H]1O[C@H]1[C@@]1(OC)OCc2c(OC[C@@H](O)C(C)(C)O)cccc21
InChIInChI=1S/C22H34O7/c1-5-6-7-10-16(23)19-20(29-19)22(26-4)15-9-8-11-17(14(15)12-28-22)27-13-18(24)21(2,3)25/h8-9,11,16,18-20,23-25H,5-7,10,12-13H2,1-4H3/t16-,18-,19+,20-,22+/m1/s1
InChIKeyWISMZOQIFLTUPK-KQDNOMNESA-N
Species of MetaboliteComponentSourceComments
Colletotrichum (ncbitaxon:5455) - PubMed (32216287)
ChEBI Ontology
Outgoing Relation(s)
Colletofuran D (CHEBI:217511) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
(2R)-1-[[(1S)-1-[(2R,3S)-3-[(1R)-1-hydroxyhexyl]oxiran-2-yl]-1-methoxy-3H-2-benzouran-4-yl]oxy]-3-methylbutane-2,3-diol