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CHEBI:213927 - Trienomycin I

ChEBI IDCHEBI:213927
ChEBI NameTrienomycin I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H37NO6
Net Charge0
Average Mass483.605
Monoisotopic Mass483.26209
SMILESCO[C@H]1/C=C/C=C/C=C/C[C@H](OC(C)=O)[C@H](C)[C@@H](O)/C(C)=C\CCc2cc(O)cc(c2)NC(=O)C1
InChIInChI=1S/C28H37NO6/c1-19-11-10-12-22-15-23(17-24(31)16-22)29-27(32)18-25(34-4)13-8-6-5-7-9-14-26(35-21(3)30)20(2)28(19)33/h5-9,11,13,15-17,20,25-26,28,31,33H,10,12,14,18H2,1-4H3,(H,29,32)/b6-5+,9-7+,13-8+,19-11-/t20-,25-,26-,28-/m0/s1
InChIKeyZDMGJRKPKOPHRY-DLQUQATOSA-N
Species of MetaboliteComponentSourceComments
Ochrobactrum (ncbitaxon:528) - PubMed (30111735)
ChEBI Ontology
Outgoing Relation(s)
Trienomycin I (CHEBI:213927) is a phenols (CHEBI:33853)
IUPAC Name 
[(5R,6E,8E,10E,13S,14R,15R,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] acetate
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68003745ChemSpider