CHEBI:207208 - Macrosphelide M

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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 Macrosphelide M
ChEBI ID CHEBI:207208
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H22O8
Net Charge 0
Average Mass 342.344
Monoisotopic Mass 342.13147
InChI InChI=1S/C16H22O8/c1-9-8-16(21)24-13(10(2)17)5-7-15(20)23-11(3)12(18)4-6-14(19)22-9/h4-7,9-13,17-18H,8H2,1-3H3/b6-4-,7-5?/t9-,10+,11+,12-,13-/m1/s1
InChIKey IGBLHBGVKNSTOR-ZSVFRNJNSA-N
SMILES O=C1O[C@H]([C@H](O)C=CC(=O)O[C@@H](CC(O[C@H](C=C1)[C@@H](O)C)=O)C)C
Metabolite of Species Details
Periconiaspecies (NCBI:txid1756127) See: PubMed
ChEBI Ontology
Outgoing Macrosphelide M (CHEBI:207208) is a macrolide (CHEBI:25106)
IUPAC Name
(2R,6R,11S,12R,13Z)-12-hydroxy-6-[(1S)-1-hydroxyethyl]-2,11-dimethyl-1,5,10-trioxacyclopentadeca-7,13-diene-4,9,15-trione