CHEBI:223143 - Wailupemycin A

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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 Wailupemycin A
ChEBI ID CHEBI:223143
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C21H22O8
Net Charge 0
Average Mass 402.399
Monoisotopic Mass 402.13147
InChI InChI=1S/C21H22O8/c1-28-15-8-16(29-19(25)9-15)11-20(26)10-14(22)7-18(24)21(20,27)12-17(23)13-5-3-2-4-6-13/h2-6,8-9,14,22,26-27H,7,10-12H2,1H3/t14-,20-,21-/m0/s1
InChIKey ZONQALFJVQODID-WVFSVQOHSA-N
SMILES O=C1OC(=CC(=C1)OC)C[C@]2(O)[C@@](O)(C(=O)C[C@@H](C2)O)CC(=O)C3=CC=CC=C3
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: DOI
ChEBI Ontology
Outgoing Wailupemycin A (CHEBI:223143) is a aromatic ketone (CHEBI:76224)
IUPAC Name
4-methoxy-6-[[(1S,2R,5R)-1,2,5-trihydroxy-3-oxo-2-phenacylcyclohexyl]methyl]pyran-2-one
Manual Xref Database
8986395 ChemSpider
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