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CHEBI:219060 - Phoslactomycin E

ChEBI IDCHEBI:219060
ChEBI NamePhoslactomycin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H50NO10P
Net Charge0
Average Mass639.723
Monoisotopic Mass639.31723
SMILESCC[C@H]1C=CC(=O)O[C@H]1C=C[C@](O)(CCN)[C@H](C[C@H](O)C=CC=C[C@@H]1CCC[C@H](OC(=O)C2CCCCC2)C1)OP(=O)(O)O
InChIInChI=1S/C32H50NO10P/c1-2-24-15-16-30(35)42-28(24)17-18-32(37,19-20-33)29(43-44(38,39)40)22-26(34)13-7-6-9-23-10-8-14-27(21-23)41-31(36)25-11-4-3-5-12-25/h6-7,9,13,15-18,23-29,34,37H,2-5,8,10-12,14,19-22,33H2,1H3,(H2,38,39,40)/t23-,24+,26-,27+,28+,29+,32+/m1/s1
InChIKeyVPPYLHODJVARBC-MAAOCNLLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (18277002)
ChEBI Ontology
Outgoing Relation(s)
Phoslactomycin E (CHEBI:219060) is a pyranone (CHEBI:37963)
IUPAC Name 
[(1S,3R)-3-[(5S,7S,8R)-8-(2-aminoethyl)-10-[(2S,3S)-3-ethyl-6-oxo-2,3-dihydropyran-2-yl]-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] cyclohexanecarboxylate