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CHEBI:46201 - (2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID

Default Structure
ChEBI IDCHEBI:46201
ChEBI Name(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC13H16N2O7S
Net Charge0
Average Mass344.345
Monoisotopic Mass344.06782
SMILES[H]OC(=O)[C@]([H])(C([H])([H])N([H])S(=O)(=O)c1c([H])c([H])c([N+](=O)[O-])c([H])c1[H])[C@@]([H])(C([H])=O)C([H])([H])C([H])([H])[H]
InChIInChI=1S/C13H16N2O7S/c1-2-9(8-16)12(13(17)18)7-14-23(21,22)11-5-3-10(4-6-11)15(19)20/h3-6,8-9,12,14H,2,7H2,1H3,(H,17,18)/t9-,12-/m1/s1
InChIKeyJPQYVEFTAZEPOD-BXKDBHETSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID (CHEBI:46201) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2S,3S)-3-formyl-2-({[(4-nitrophenyl)sulfonyl]amino}methyl)pentanoic acidPDBeChem
(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACIDPDBeChem
Manual XrefsDatabases
TPYPDBeChem