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CHEBI:205322 - 20-O-methyl-24-epi-cyclocitrinol

ChEBI IDCHEBI:205322
ChEBI Name20-O-methyl-24-epi-cyclocitrinol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H38O4
Net Charge0
Average Mass414.586
Monoisotopic Mass414.27701
SMILESCO[C@@](C)(/C=C/[C@H](C)O)C1CC[C@H]2C3=CC(=O)[C@H]4CC(=CC[C@H](O)C4)[C@H]3CC[C@]12C
InChIInChI=1S/C26H38O4/c1-16(27)9-12-26(3,30-4)24-8-7-22-21-15-23(29)18-13-17(5-6-19(28)14-18)20(21)10-11-25(22,24)2/h5,9,12,15-16,18-20,22,24,27-28H,6-8,10-11,13-14H2,1-4H3/b12-9+/t16-,18-,19-,20+,22-,24?,25-,26-/m0/s1
InChIKeyJLTZJSMHAJUVNI-OLOWAZIMSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (18656987)
ChEBI Ontology
Outgoing Relation(s)
20-O-methyl-24-epi-cyclocitrinol (CHEBI:205322) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
(2R,5S,9R,13S,15S)-15-hydroxy-6-[(E,2S,5S)-5-hydroxy-2-methoxyhex-3-en-2-yl]-5-methyltetracyclo[11.4.1.02,10.05,9]octadeca-1(17),10-dien-12-one
Manual XrefsDatabases
78437267ChemSpider