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CHEBI:207108 - Abybetaomicin V

ChEBI IDCHEBI:207108
ChEBI NameAbybetaomicin V
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O7
Net Charge0
Average Mass378.421
Monoisotopic Mass378.16785
SMILESC[C@@H]1C[C@H](C)C(=O)C2=C3O[C@@]4(C)[C@@H](CO)C[C@]3(OC2=O)[C@@H](CCC1=O)[C@@H]4O
InChIInChI=1S/C20H26O7/c1-9-6-10(2)15(23)14-17-20(27-18(14)25)7-11(8-21)19(3,26-17)16(24)12(20)4-5-13(9)22/h9-12,16,21,24H,4-8H2,1-3H3/t9-,10+,11-,12+,16+,19+,20+/m1/s1
InChIKeyZTMDLJADCRURSE-KJXJVICLSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies LC-6-2 (ncbitaxon:1676287) - PubMed (28358212)
ChEBI Ontology
Outgoing Relation(s)
Abybetaomicin V (CHEBI:207108) is a oxanes (CHEBI:46942)
IUPAC Name 
(1S,2S,3S,7R,9S,14S,16R)-2-hydroxy-16-(hydroxymethyl)-1,7,9-trimethyl-13,17-dioxatetracyclo[9.5.2.03,14.014,18]octadec-11(18)-ene-6,10,12-trione