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(Q82165649)
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English
(2S,3S)-3-(Z-amino)-2-hydroxy-4-phenylbutyric acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
329.12632270800003
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
3-BENZYLOXYCARBONYLAMINO-2-HYDROXY-4-PHENYL-BUTYRIC ACID
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
N-Cbz-(2R,3R)-3-amino-2-hydroxy-4-phenylbutyric acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(aR,bS)-rel-alpha-Hydroxy-beta-[[(phenylmethoxy)carbonyl]amino]benzenebutanoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₁₉NO₅
0 references
canonical SMILES
O=C(NC(Cc1ccccc1)C(O)C(=O)O)OCc1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=CC=C(C=C1)C[C@@H]([C@@H](C(=O)O)O)NC(=O)OCC2=CC=CC=C2
0 references
Identifiers
InChI
InChI=1S/C18H19NO5/c20-16(17(21)22)15(11-13-7-3-1-4-8-13)19-18(23)24-12-14-9-5-2-6-10-14/h1-10,15-16,20H,11-12H2,(H,19,23)(H,21,22)/t15-,16-/m0/s1
0 references
InChIKey
JXJYTERRLRAUSF-HOTGVXAUSA-N
0 references
CAS Registry Number
62023-59-0
0 references
PubChem CID
2763099
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
JXJYTERRLRAUSF-HOTGVXAUSA-N
UniChem compound ID
24947063
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00376737
1 reference
matched by identifier from
InChIKey
InChIKey
JXJYTERRLRAUSF-HOTGVXAUSA-N
DSSTOX compound identifier
DTXCID60327765
0 references
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