Boc-homo-L-tyrosine

C₁₅H₂₁NO₅CAS 198473-94-8295.34 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Phenol

Properties

Molecular formula: C₁₅H₂₁NO₅
Molar mass: 295.34 g/mol
Exact mass: 295.1420 Da
logP: 2.30Crippen estimate
Polar surface area: 95.9 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

198473-94-8

SMILES

CC(C)(C)OC(=O)N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O

InChIKey

CDPGKTTZDRPESV-LBPRGKRZSA-N

InChI

InChI=1S/C15H21NO5/c1-15(2,3)21-14(20)16-12(13(18)19)9-6-10-4-7-11(17)8-5-10/h4-5,7-8,12,17H,6,9H2,1-3H3,(H,16,20)(H,18,19)/t12-/m0/s1

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Names and synonyms

1 names

Boc-hotyr-OH

Work with Boc-homo-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

Boc-L-homophenylalanine100564-78-180 % similar Boc-4-iodo-D-phenylalanine176199-35-263 % similar Boc-D-4,4'-biphenylalanine128779-47-562 % similar Boc-L-4,4'-biphenylalanine147923-08-862 % similar Fmoc-homo-L-tyrosine198560-10-061 % similar Boc-D-glu(otbu)-oh104719-63-360 % similar Boc-L-3,4-difluorophe198474-90-759 % similar Boc-D-bpa-oh117666-94-158 % similar

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

Same formula

Methyl (αR,βS)-β-[[(1,1-dimethylethoxy)carbonyl]amino]-α-hydroxybenzenepropanoate124605-42-1 Boc-D-ser-obzl141527-78-8 O-(1,1-Dimethylethyl)-N-[(phenylmethoxy)carbonyl]-L-serine1676-75-1 N-tert-Butoxycarbonyl-O-benzylserine23680-31-1

Elsewhere

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