CHEBI:215774 - (6S,9S,10S,13R)-6,10,21-trihydroxy-13-methoxy-7,9,17-trimethyl-3-oxabicyclo[17.3.1]tricosa-1(22),7,14,16,19(23),20-hexaene-4,12-dione

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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 (6S,9S,10S,13R)-6,10,21-trihydroxy-13-methoxy-7,9,17-trimethyl-3-oxabicyclo[17.3.1]tricosa-1(22),7,14,16,19(23),20-hexaene-4,12-dione
ChEBI ID CHEBI:215774
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H34O7
Net Charge 0
Average Mass 458.551
Monoisotopic Mass 458.23045
InChI InChI=1S/C26H34O7/c1-16-6-5-7-25(32-4)24(30)13-22(28)17(2)9-18(3)23(29)14-26(31)33-15-20-10-19(8-16)11-21(27)12-20/h5-7,9-12,17,22-23,25,27-29H,8,13-15H2,1-4H3/t17-,22-,23-,25+/m0/s1
InChIKey LMHCDCVJIJVZPB-XVYJZYCRSA-N
SMILES O=C1OCC2=CC(O)=CC(=C2)CC(=CC=C[C@H](C(C[C@@H]([C@H](C=C([C@H](C1)O)C)C)O)=O)OC)C
Metabolite of Species Details
Actinosynnema pretiosum (NCBI:txid42197) See: PubMed
ChEBI Ontology
Outgoing (6S,9S,10S,13R)-6,10,21-trihydroxy-13-methoxy-7,9,17-trimethyl-3-oxabicyclo[17.3.1]tricosa-1(22),7,14,16,19(23),20-hexaene-4,12-dione (CHEBI:215774) is a macrolide (CHEBI:25106)
IUPAC Name
(6S,9S,10S,13R)-6,10,21-trihydroxy-13-methoxy-7,9,17-trimethyl-3-oxabicyclo[17.3.1]tricosa-1(22),7,14,16,19(23),20-hexaene-4,12-dione