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CHEBI:205960 - Iedoglucomide A

ChEBI IDCHEBI:205960
ChEBI NameIedoglucomide A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H53NO12
Net Charge0
Average Mass619.749
Monoisotopic Mass619.35678
SMILESCC(C)[C@@H](CCCCCCCCCCCCC(=O)N[C@@H](C)C(=O)O)O[C@@H]1O[C@H](COC(=O)CCC(=O)O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C30H53NO12/c1-19(2)21(14-12-10-8-6-4-5-7-9-11-13-15-23(32)31-20(3)29(39)40)42-30-28(38)27(37)26(36)22(43-30)18-41-25(35)17-16-24(33)34/h19-22,26-28,30,36-38H,4-18H2,1-3H3,(H,31,32)(H,33,34)(H,39,40)/t20-,21+,22+,26+,27-,28+,30+/m0/s1
InChIKeyBWOYGAJJTBJKTQ-NPKYFSSWSA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - PubMed (22360451)
ChEBI Ontology
Outgoing Relation(s)
Iedoglucomide A (CHEBI:205960) is a lipopolysaccharide (CHEBI:16412)
IUPAC Name 
4-[[(2R,3S,4S,5R,6R)-6-[(3R)-16-[[(1S)-1-carboxyethyl]amino]-2-methyl-16-oxohexadecan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-oxobutanoic acid
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