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CHEBI:198302 - Hydroxyplatensic acid methyl ester

ChEBI IDCHEBI:198302
ChEBI NameHydroxyplatensic acid methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O5
Net Charge0
Average Mass320.385
Monoisotopic Mass320.16237
SMILESCOC(=O)CC[C@]1(C)C(=O)C=C[C@]23CC4C[C@H](O[C@@]4(C)[C@@H]2O)[C@H]31
InChIInChI=1S/C18H24O5/c1-16(6-5-13(20)22-3)12(19)4-7-18-9-10-8-11(14(16)18)23-17(10,2)15(18)21/h4,7,10-11,14-15,21H,5-6,8-9H2,1-3H3/t10?,11-,14-,15-,16+,17+,18+/m0/s1
InChIKeyFBBBYTFYYNYGMH-MMPVIVLBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces platensis (ncbitaxon:58346) - DOI (10.1016/j.tetlet.2009.06.118)
ChEBI Ontology
Outgoing Relation(s)
Hydroxyplatensic acid methyl ester (CHEBI:198302) is a oxacycle (CHEBI:38104)
IUPAC Name 
methyl 3-[(1S,5S,6R,7S,9R,12R)-12-hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.17,10.01,6]tridec-2-en-5-yl]propanoate
Manual XrefsDatabases
58170459ChemSpider