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(2R,5R)-2,5-diphenylpyrrolidine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
223.136099544
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(2S,5S)-2,5-diphenylpyrrolidine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₇N
0 references
canonical SMILES
c1ccc(C2CCC(c3ccccc3)N2)cc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1C[C@@H](N[C@H]1C2=CC=CC=C2)C3=CC=CC=C3
0 references
Identifiers
InChI
InChI=1S/C16H17N/c1-3-7-13(8-4-1)15-11-12-16(17-15)14-9-5-2-6-10-14/h1-10,15-17H,11-12H2/t15-,16-/m1/s1
0 references
InChIKey
NAOGHMNKMJMMNQ-HZPDHXFCSA-N
0 references
CAS Registry Number
155155-73-0
0 references
PubChem CID
10966132
1 reference
matched by identifier from
InChIKey
InChIKey
NAOGHMNKMJMMNQ-HZPDHXFCSA-N
SureChEMBL ID
SCHEMBL1763221
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NAOGHMNKMJMMNQ-HZPDHXFCSA-N
UniChem compound ID
23629575
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70450119
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
NAOGHMNKMJMMNQ-HZPDHXFCSA-N
DSSTOX compound identifier
DTXCID90400939
0 references
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