CHEBI:198463 - Cochliomycin D

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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 Cochliomycin D
ChEBI ID CHEBI:198463
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H22O7
Net Charge 0
Average Mass 362.378
Monoisotopic Mass 362.13655
InChI InChI=1S/C19H22O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3-4,6-7,9-11,15,18,21-23H,5,8H2,1-2H3/b6-4+,7-3+/t11-,15+,18+/m0/s1
InChIKey NEQZWEXWOFPKOT-KMIRMROWSA-N
SMILES O=C1O[C@H](CC=CC(=O)[C@@H](O)[C@@H](CC=CC=2C1=C(O)C=C(OC)C2)O)C
Metabolite of Species Details
Curvularia lunata (NCBI:txid5503) See: PubMed
ChEBI Ontology
Outgoing Cochliomycin D (CHEBI:198463) is a macrolide (CHEBI:25106)
Cochliomycin D (CHEBI:198463) is a resorcinols (CHEBI:33572)
IUPAC Name
(4S,6E,9S,10R,12E)-9,10,18-trihydroxy-16-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,12,15,17-pentaene-2,8-dione
Manual Xref Database
32674689 ChemSpider
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