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132388-57-9 | L-Asparagine, N2-[(phenylmethoxy)carbonyl]-N-(triphenylmethyl)-
CAS No: 132388-57-9 Catalog No: AG0010MR MDL No:MFCD00153326
Product Description
Catalog Number:
AG0010MR
Chemical Name:
L-Asparagine, N2-[(phenylmethoxy)carbonyl]-N-(triphenylmethyl)-
CAS Number:
132388-57-9
Molecular Formula:
C31H28N2O5
Molecular Weight:
508.5644
MDL Number:
MFCD00153326
IUPAC Name:
(2S)-4-oxo-2-(phenylmethoxycarbonylamino)-4-(tritylamino)butanoic acid
InChI:
InChI=1S/C31H28N2O5/c34-28(21-27(29(35)36)32-30(37)38-22-23-13-5-1-6-14-23)33-31(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27H,21-22H2,(H,32,37)(H,33,34)(H,35,36)/t27-/m0/s1
InChI Key:
FPVBKISSJULIGI-MHZLTWQESA-N
SMILES:
NC(=O)C[C@H](N(C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OCc1ccccc1)C(=O)O
Properties
Complexity:
717
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
508.2g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
508.574g/mol
Monoisotopic Mass:
508.2g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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