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CHEBI:182715 - (4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide

Default Structure
ChEBI IDCHEBI:182715
ChEBI Name(4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H23N3O7
Net Charge0
Average Mass429.429
Monoisotopic Mass429.15360
SMILESC[C@H]1OC(c2cccc(O)c2O)=N[C@@H]1C(=O)NCCCNC(=O)c1cccc(O)c1O
InChIInChI=1S/C21H23N3O7/c1-11-16(24-21(31-11)13-6-3-8-15(26)18(13)28)20(30)23-10-4-9-22-19(29)12-5-2-7-14(25)17(12)27/h2-3,5-8,11,16,25-28H,4,9-10H2,1H3,(H,22,29)(H,23,30)/t11-,16+/m1/s1
InChIKeyQSJOEQXFYCTBSY-BZNIZROVSA-N
ChEBI Ontology
Outgoing Relation(s)
(4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide (CHEBI:182715) is a salicylamides (CHEBI:53443)
IUPAC Name 
(4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide
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