chempirical

Phospho-L-tyrosine

C9H12NO6PCAS 21820-51-9261.17 g/mol

Open in Covalent MOL file
H2NOPOOHOHOHO
Carboxylic acidPhosphatePrimary amine

Properties

Molecular formula
C9H12NO6P
Molar mass
261.17 g/mol
Exact mass
261.0402 Da
Melting point
225 °C
logP
0.11Crippen estimate
Polar surface area
130.1 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
21820-51-9
SMILES
N[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)O
InChIKey
DCWXELXMIBXGTH-QMMMGPOBSA-N
InChI
InChI=1S/C9H12NO6P/c10-8(9(11)12)5-6-1-3-7(4-2-6)16-17(13,14)15/h1-4,8H,5,10H2,(H,11,12)(H2,13,14,15)/t8-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • L-Tyrosine, O-phosphono-
  • Tyrosine, dihydrogen phosphate (ester), L-
  • L-Tyrosine, dihydrogen phosphate (ester)
  • Tyrosine, di-H phosphate
  • Tyrosine, phosphate
  • O-Phosphono-L-tyrosine
  • Tyrosine O-phosphate
  • O-Phospho-L-tyrosine
  • O-Phosphotyrosine
  • Phosphotyrosine
  • L-Phosphotyrosine
  • L-Tyrosine-O-phosphate
  • (2S)-2-Amino-3-(4-phosphonooxyphenyl)propanoic acid

Work with Phospho-L-tyrosine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

O-Methyl-D-tyrosine39878-65-463 % similar O-Methyl-L-tyrosine6230-11-163 % similar Dl-thyronine1034-10-261 % similar Thyronine1596-67-461 % similar O-tert-Butyl-L-tyrosine18822-59-859 % similar D-Tyrosine556-02-559 % similar Dl-tyrosine556-03-659 % similar Tyrosine60-18-459 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook