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CHEBI:204161 - 15alpha-methoxy-O-methyldihydrobotrydial

ChEBI IDCHEBI:204161
ChEBI Name15alpha-methoxy-O-methyldihydrobotrydial
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H32O6
Net Charge0
Average Mass356.459
Monoisotopic Mass356.21989
SMILESCO[C@H]1O[C@H](OC)[C@@]2(C)CC(C)(C)[C@@H]3[C@@H](OC(C)=O)C[C@@H](C)[C@H]1[C@@]32O
InChIInChI=1S/C19H32O6/c1-10-8-12(24-11(2)20)14-17(3,4)9-18(5)16(23-7)25-15(22-6)13(10)19(14,18)21/h10,12-16,21H,8-9H2,1-7H3/t10-,12+,13-,14+,15+,16+,18-,19-/m1/s1
InChIKeyUVJBMYJHRMQRSJ-IHFWDFRQSA-N
Species of MetaboliteComponentSourceComments
Botrytis cinerea (ncbitaxon:40559) - PubMed (10691704)
ChEBI Ontology
Outgoing Relation(s)
15alpha-methoxy-O-methyldihydrobotrydial (CHEBI:204161) is a oxanes (CHEBI:46942)
IUPAC Name 
[(1R,4S,5S,7S,8S,9R,11S,12S)-12-hydroxy-5,7-dimethoxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.04,12]dodecan-11-yl] acetate
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8983502ChemSpider