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CHEBI:213259 - Lactomycin B

ChEBI IDCHEBI:213259
ChEBI NameLactomycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H39NO6
Net Charge0
Average Mass449.588
Monoisotopic Mass449.27774
SMILESCC[C@H]1C=CC(=O)O[C@H]1/C=C/[C@](O)(CCN)[C@H](O)C[C@@H](O)/C=C\C=C/[C@@H]1CCC[C@H](O)C1
InChIInChI=1S/C25H39NO6/c1-2-19-10-11-24(30)32-22(19)12-13-25(31,14-15-26)23(29)17-21(28)8-4-3-6-18-7-5-9-20(27)16-18/h3-4,6,8,10-13,18-23,27-29,31H,2,5,7,9,14-17,26H2,1H3/b6-3-,8-4-,13-12+/t18-,19+,20+,21+,22+,23-,25+/m1/s1
InChIKeyWAEFDBPQINDPOQ-OVPPXBFPSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29466301)
ChEBI Ontology
Outgoing Relation(s)
Lactomycin B (CHEBI:213259) is a pyranone (CHEBI:37963)
IUPAC Name 
(2S,3S)-2-[(1E,3R,4R,6R,7Z,9Z)-3-(2-aminoethyl)-3,4,6-trihydroxy-10-[(1R,3S)-3-hydroxycyclohexyl]deca-1,7,9-trienyl]-3-ethyl-2,3-dihydropyran-6-one
Manual XrefsDatabases
64868956ChemSpider