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(Q81977373)
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English
N2-(1-Carboxy-3-phenylpropyl)-L-lysyl-L-proline
group of stereoisomers with the chemical formula C₂₁H₃₁N₃O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
405.22637109199997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₁N₃O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NCCCCC(NC(CCc1ccccc1)C(=O)O)C(=O)N1CCCC1C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
NCCCC[C@H](NC(CCc1ccccc1)C(=O)O)C(=O)N1CCC[C@H]1C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C21H31N3O5/c22-13-5-4-9-16(19(25)24-14-6-10-18(24)21(28)29)23-17(20(26)27)12-11-15-7-2-1-3-8-15/h1-3,7-8,16-18,23H,4-6,9-14,22H2,(H,26,27)(H,28,29)/t16-,17?,18-/m0/s1
0 references
InChIKey
RLAWWYSOJDYHDC-RGBJRUIASA-N
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CAS Registry Number
77726-95-5
0 references
PubChem CID
6321211
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RLAWWYSOJDYHDC-RGBJRUIASA-N
UniChem compound ID
26978255
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40273938
1 reference
matched by identifier from
InChIKey
InChIKey
RLAWWYSOJDYHDC-RGBJRUIASA-N
DSSTOX compound identifier
DTXCID30819940
0 references
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