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CHEBI:46193 - METHYL N-{(2S,3R)-3-AMINO-2-HYDROXY-3-[4-(TRIFLUOROMETHYL)PHENYL]PROPANOYL}ALANYLGLYCINATE

Default Structure
ChEBI IDCHEBI:46193
ChEBI NameMETHYL N-{(2S,3R)-3-AMINO-2-HYDROXY-3-[4-(TRIFLUOROMETHYL)PHENYL]PROPANOYL}ALANYLGLYCINATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H20F3N3O5
Net Charge0
Average Mass391.346
Monoisotopic Mass391.13551
SMILES[H]O[C@]([H])(C(=O)N([H])[C@]([H])(C(=O)N([H])C([H])([H])C(=O)OC([H])([H])[H])C([H])([H])[H])[C@@]([H])(c1c([H])c([H])c(C(F)(F)F)c([H])c1[H])N([H])[H]
InChIInChI=1S/C16H20F3N3O5/c1-8(14(25)21-7-11(23)27-2)22-15(26)13(24)12(20)9-3-5-10(6-4-9)16(17,18)19/h3-6,8,12-13,24H,7,20H2,1-2H3,(H,21,25)(H,22,26)/t8-,12+,13-/m0/s1
InChIKeyKTNRONBAQGRLNO-CKLFPEKLSA-N
ChEBI Ontology
Outgoing Relation(s)
METHYL N-{(2S,3R)-3-AMINO-2-HYDROXY-3-[4-(TRIFLUOROMETHYL)PHENYL]PROPANOYL}ALANYLGLYCINATE (CHEBI:46193) is a unclassifieds (CHEBI:27189)
Synonyms  Source
METHYL N-{(2S,3R)-3-AMINO-2-HYDROXY-3-[4-(TRIFLUOROMETHYL)PHENYL]PROPANOYL}ALANYLGLYCINATEPDBeChem
methyl N-{(2S,3R)-3-amino-2-hydroxy-3-[4-(trifluoromethyl)phenyl]propanoyl}-L-alanylglycinatePDBeChem
Manual XrefsDatabases
U11PDBeChem