CHEBI:208735 - Atrop-Abybetaomicin C

ChEBI IDCHEBI:208735
ChEBI NameAtrop-Abybetaomicin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22O6
Net Charge0
Average Mass346.379
Monoisotopic Mass346.14164
SMILESCC1CC(C)C(=O)C2=C3OC4C(C)CC3(OC2=O)C(/C=C\C1=O)C4O
InChIInChI=1S/C19H22O6/c1-8-6-9(2)14(21)13-17-19(25-18(13)23)7-10(3)16(24-17)15(22)11(19)4-5-12(8)20/h4-5,8-11,15-16,22H,6-7H2,1-3H3/b5-4-
InChIKeyFNEADFUPWHAVTA-PLNGDYQASA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (17617698)
ChEBI Ontology
Outgoing Relation(s)
Atrop-Abybetaomicin C (CHEBI:208735) is a oxanes (CHEBI:46942)
IUPAC Name 
(4Z)-2-hydroxy-7,9,16-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadeca-4,11(18)-diene-6,10,12-trione
Manual XrefsDatabases
9614262ChemSpider