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CHEBI:197847 - Mangromicin A

ChEBI IDCHEBI:197847
ChEBI NameMangromicin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O7
Net Charge0
Average Mass410.507
Monoisotopic Mass410.23045
SMILESCCC[C@@H]1C(O)=C2CC[C@]3(C)C[C@@H](C)[C@H](O3)[C@@H](O)[C@H](O)[C@H](C)C(=O)C[C@@H]1OC2=O
InChIInChI=1S/C22H34O7/c1-5-6-13-16-9-15(23)12(3)17(24)19(26)20-11(2)10-22(4,29-20)8-7-14(18(13)25)21(27)28-16/h11-13,16-17,19-20,24-26H,5-10H2,1-4H3/t11-,12-,13+,16+,17-,19+,20+,22-/m1/s1
InChIKeyGBPHFARFCUQUHR-NUYKDRIWSA-N
Species of MetaboliteComponentSourceComments
Lentzea (ncbitaxon:165301) - PubMed (24326338)
ChEBI Ontology
Outgoing Relation(s)
Mangromicin A (CHEBI:197847) is a pyranone (CHEBI:37963)
IUPAC Name 
(4R,6R,7S,8S,9R,10S,13S,17S)-8,9,16-trihydroxy-4,6,10-trimethyl-17-propyl-14,18-dioxatricyclo[11.2.2.14,7]octadec-1(16)-ene-11,15-dione
Manual XrefsDatabases
78436290ChemSpider