chempirical

Carbobenzoxy-L-tyrosine

C17H17NO5CAS 1164-16-5315.32 g/mol

Open in Covalent MOL file
OHOOHNHOO
Carboxylic acidPhenol

Properties

Molecular formula
C17H17NO5
Molar mass
315.32 g/mol
Exact mass
315.1107 Da
Melting point
95–96 °C
logP
2.52Crippen estimate
Polar surface area
99.3 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
1164-16-5
SMILES
O=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)OCc1ccccc1
InChIKey
MCRMUCXATQAAMN-HNNXBMFYSA-N
InChI
InChI=1S/C17H17NO5/c19-14-8-6-12(7-9-14)10-15(16(20)21)18-17(22)23-11-13-4-2-1-3-5-13/h1-9,15,19H,10-11H2,(H,18,22)(H,20,21)/t15-/m0/s1

Weigh it out

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

Names and synonyms

19 names · show all
  • L-Tyrosine, N-[(phenylmethoxy)carbonyl]-
  • N-Carbobenzoxytyrosine
  • L-(Carbobenzyloxy)tyrosine
  • N-Carbobenzyloxy-L-tyrosine
  • NSC 88488
  • N-CBZ-L-tyrosine
  • (2S)-2-(Benzyloxycarbonylamino)-3-(4-hydroxyphenyl)propanoic acid
  • (2S)-2-[[(Benzyloxy)carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • (2S)-3-(4-Hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid
  • Tyrosine, N-carboxy-, N-benzyl ester, L-
  • Tyrosine, N-carboxy-, N-benzyl ester
  • N-[(Phenylmethoxy)carbonyl]-L-tyrosine
  • N-Carbobenzoxy-L-tyrosine
  • N-(Benzyloxycarbonyl)-L-tyrosine
  • Carbobenzoxytyrosine
  • Benzyloxycarbonyl-L-tyrosine
  • N-(Benzyloxycarbonyl)tyrosine
  • (Benzyloxycarbonyl)tyrosine
  • N-Benzyloxycarbonyl-l-tyrosine

Work with Carbobenzoxy-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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Z-D-Tyr-oh64205-12-5Enantiomer

Similar compounds

Benzyloxycarbonyl-L-phenylalanine1161-13-388 % similar N-(Benzyloxycarbonyl)-D-phenylalanine2448-45-588 % similar N-(Benzyloxycarbonyl)-dl-phenylalanine3588-57-688 % similar N-[(Phenylmethoxy)carbonyl]-L-tyrosine methyl ester13512-31-774 % similar O-(1,1-Dimethylethyl)-N-[(phenylmethoxy)carbonyl]-L-tyrosine5545-54-071 % similar N-(Benzyloxycarbonyl)-L-serine1145-80-870 % similar N-Benzyloxycarbonyl-DL-serine2768-56-170 % similar N-((Phenylmethoxy)carbonyl)-O-(phenylmethyl)-L-serine20806-43-368 % similar

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

Elsewhere

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