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17730-18-6 | L-Methionine, 1-[(phenylmethoxy)carbonyl]-L-prolyl-
CAS No: 17730-18-6 Catalog No: AG00257U MDL No:
Product Description
Catalog Number:
AG00257U
Chemical Name:
L-Methionine, 1-[(phenylmethoxy)carbonyl]-L-prolyl-
CAS Number:
17730-18-6
Molecular Formula:
C18H24N2O5S
Molecular Weight:
380.4586
IUPAC Name:
(2S)-4-methylsulfanyl-2-[[(2S)-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl]amino]butanoic acid
InChI:
InChI=1S/C18H24N2O5S/c1-26-11-9-14(17(22)23)19-16(21)15-8-5-10-20(15)18(24)25-12-13-6-3-2-4-7-13/h2-4,6-7,14-15H,5,8-12H2,1H3,(H,19,21)(H,22,23)/t14-,15-/m0/s1
InChI Key:
QHSSZNCPOQRYPJ-GJZGRUSLSA-N
SMILES:
CSCC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1
EC Number:
241-723-3
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
380.141g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
380.459g/mol
Monoisotopic Mass:
380.141g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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