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CHEBI:201637 - Mangromicin E

Default Structure
ChEBI IDCHEBI:201637
ChEBI NameMangromicin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32O6
Net Charge0
Average Mass392.492
Monoisotopic Mass392.21989
SMILESCCC[C@H]1C(=O)C2CC[C@@]3(C)C[C@H](C)[C@@H](O3)[C@H](O)C=C(C)C(=O)C[C@H]1OC2=O
InChIInChI=1S/C22H32O6/c1-5-6-14-18-10-16(23)12(2)9-17(24)20-13(3)11-22(4,28-20)8-7-15(19(14)25)21(26)27-18/h9,13-15,17-18,20,24H,5-8,10-11H2,1-4H3/t13-,14+,15?,17+,18+,20+,22-/m0/s1
InChIKeyOCWVRBPZJAHHBB-LVDVZRQQSA-N
Species of MetaboliteComponentSourceComments
Lentzea (ncbitaxon:165301) - PubMed (24690908)
ChEBI Ontology
Outgoing Relation(s)
Mangromicin E (CHEBI:201637) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,6S,7R,8R,13R,17R)-8-hydroxy-4,6,10-trimethyl-17-propyl-14,18-dioxatricyclo[11.2.2.14,7]octadec-9-ene-11,15,16-trione