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191348-16-0 | L-Tyrosine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-O-[hydroxy(phenylmethoxy)phosphinyl]-
CAS No: 191348-16-0 Catalog No: AG002F5Y MDL No:MFCD00797871
Product Description
Catalog Number:
AG002F5Y
Chemical Name:
L-Tyrosine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-O-[hydroxy(phenylmethoxy)phosphinyl]-
CAS Number:
191348-16-0
Molecular Formula:
C31H28NO8P
Molecular Weight:
573.5297
MDL Number:
MFCD00797871
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-[hydroxy(phenylmethoxy)phosphoryl]oxyphenyl]propanoic acid
InChI:
InChI=1S/C31H28NO8P/c33-30(34)29(18-21-14-16-23(17-15-21)40-41(36,37)39-19-22-8-2-1-3-9-22)32-31(35)38-20-28-26-12-6-4-10-24(26)25-11-5-7-13-27(25)28/h1-17,28-29H,18-20H2,(H,32,35)(H,33,34)(H,36,37)/t29-/m0/s1
InChI Key:
WNFKGEXQEWKECX-LJAQVGFWSA-N
SMILES:
O=C(N[C@H](C(=O)O)Cc1ccc(cc1)OP(=O)(OCc1ccccc1)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
896
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
573.155g/mol
Formal Charge:
0
Heavy Atom Count:
41
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
573.538g/mol
Monoisotopic Mass:
573.155g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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