CHEBI:198302 - Hydroxyplatensic acid methyl ester

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Hydroxyplatensic acid methyl ester
ChEBI ID CHEBI:198302
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H24O5
Net Charge 0
Average Mass 320.385
Monoisotopic Mass 320.16237
InChI InChI=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
InChIKey FBBBYTFYYNYGMH-MMPVIVLBSA-N
SMILES O=C1C=C[C@]23[C@@H](O)[C@]4(C)O[C@H]([C@H]2[C@@]1(CCC(=O)OC)C)CC4C3
Metabolite of Species Details
Streptomyces platensis (NCBI:txid58346) See: DOI
ChEBI Ontology
Outgoing 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 Xref Database
58170459 ChemSpider
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