N-Alpha-Benzyloxycarbonyl-L-ornithine

C₁₃H₁₈N₂O₄CAS 2640-58-6266.30 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Primary amine

Properties

Molecular formula: C₁₃H₁₈N₂O₄
Molar mass: 266.30 g/mol
Exact mass: 266.1267 Da
logP: 1.10Crippen estimate
Polar surface area: 101.6 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 7
Stereocentres: Sin SMILES atom order

Hazards

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

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Identifiers

CAS number

2640-58-6

SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CCCN)C(=O)O

InChIKey

ZYGRWJVRLNJIMR-NSHDSACASA-N

InChI

InChI=1S/C13H18N2O4/c14-8-4-7-11(12(16)17)15-13(18)19-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,15,18)(H,16,17)/t11-/m0/s1

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Names and synonyms

1 names

Z-Orn-oh

Work with N-Alpha-Benzyloxycarbonyl-L-ornithine

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

Z-D-Lys-oh70671-54-493 % similar N-Carbobenzoxy-dl-norleucine15027-13-175 % similar Z-D-Gln-oh13139-52-171 % similar Z-D-Nva-oh42918-89-871 % similar Z-D-Glu-oh63648-73-769 % similar N-Cbz-D-serine6081-61-468 % similar Z-Dl-asparagine29880-22-667 % similar Z-D-Glu(ome)-oh27025-24-767 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Boc-3-(3-pyridyl)-L-alanine117142-26-4 Diethyl bis(2-cyanoethyl)malonate1444-05-9 Musk tibetene145-39-1 N5-[(Phenylmethoxy)carbonyl]-L-ornithine3304-51-6 Boc-3-(2-pyridyl)-Ala-OH71239-85-5 Boc-D-2-pyridylalanine98266-32-1 (αR)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]-3-pyridinepropanoic acid98266-33-2

Elsewhere

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