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921934-30-7 | L-Serine, L-seryl-O-(phenylmethyl)-
CAS No: 921934-30-7 Catalog No: AG006FTI MDL No:
Product Description
Catalog Number:
AG006FTI
Chemical Name:
L-Serine, L-seryl-O-(phenylmethyl)-
CAS Number:
921934-30-7
Molecular Formula:
C13H18N2O5
Molecular Weight:
282.2924
IUPAC Name:
(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylmethoxypropanoic acid
InChI:
InChI=1S/C13H18N2O5/c14-10(6-16)12(17)15-11(13(18)19)8-20-7-9-4-2-1-3-5-9/h1-5,10-11,16H,6-8,14H2,(H,15,17)(H,18,19)/t10-,11-/m0/s1
InChI Key:
AXNVWYSJENBCHZ-QWRGUYRKSA-N
SMILES:
OC[C@@H](C(=O)N[C@H](C(=O)O)COCc1ccccc1)N
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
282.122g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
282.296g/mol
Monoisotopic Mass:
282.122g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.3
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