chempirical

Z-D-Tyr-oh

C17H17NO5CAS 64205-12-5315.33 g/mol

Open in Covalent MOL file
OOHNOHOHO
CarbamateCarboxylic acidPhenol

Properties

Molecular formula
C17H17NO5
Molar mass
315.33 g/mol
Exact mass
315.1107 Da
logP
2.31Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6
Stereocentres
Rin 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
64205-12-5
SMILES
C1=CC=C(C=C1)COC(=O)N[C@H](CC2=CC=C(C=C2)O)C(=O)O
InChIKey
MCRMUCXATQAAMN-OAHLLOKOSA-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-/m1/s1

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Names and synonyms

1 names
  • (R)-2-(((Benzyloxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid

Work with Z-D-Tyr-oh

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.

Carbobenzoxy-L-tyrosine1164-16-5Enantiomer

Similar compounds

Z-Tyr(bzl)-oh16677-29-579 % similar (S)-2-(((Benzyloxy)carbonyl)amino)-3-(4-fluorophenyl)propanoic acid17543-58-779 % similar Z-Tyr-obzl5513-40-678 % similar Cbz-3-(2-naphthyl)-D-alanine143218-10-473 % similar N-Cbz-D-serine6081-61-470 % similar Fmoc-D-tyr-oh112883-29-169 % similar N-Carbobenzoxy-dl-aspartic acid4515-21-367 % similar (2R)-2-(((Benzyloxy)carbonyl)amino)butanedioic acid78663-07-767 % similar

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

Elsewhere

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