N2-[(1,1-Dimethylethoxy)carbonyl]-N5-[imino(nitroamino)methyl]-L-ornithine

C11H21N5O6CAS 2188-18-3319.32 g/mol

OONHNHNHNHN+OO−OHO
Carboxylic acidGuanidineNitro

Properties

Molecular formula
C11H21N5O6
Molar mass
319.32 g/mol
Exact mass
319.1492 Da
Melting point
111–113 °C
logP
0.25Crippen estimate
Polar surface area
170.2 Ų
H-bond donors / acceptors
5 / 6
Rotatable bonds
7
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
2188-18-3
SMILES
CC(C)(C)OC(O)=N[C@@H](CCCNC(=N)N[N+](=O)[O-])C(=O)O
InChIKey
OZSSOVRIEPAIMP-ZETCQYMHSA-N
InChI
InChI=1S/C11H21N5O6/c1-11(2,3)22-10(19)14-7(8(17)18)5-4-6-13-9(12)15-16(20)21/h7H,4-6H2,1-3H3,(H,14,19)(H,17,18)(H3,12,13,15)/t7-/m0/s1

Weigh it out

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

Names and synonyms

10 names
  • L-Ornithine, N2-[(1,1-dimethylethoxy)carbonyl]-N5-[imino(nitroamino)methyl]-
  • Ornithine, N2-carboxy-N5-(nitroamidino)-, N2-tert-butyl ester, L-
  • Ornithine, N2-carboxy-N5-(nitroamidino)-, N-tert-butyl ester
  • Nα-tert-Butoxycarbonyl-NG-nitro-L-arginine
  • N2-tert-Butyloxycarbonyl-Nω-nitro-L-arginine
  • N2-tert-Butoxycarbonyl-NG-nitroarginine
  • Nα-tert-Butoxycarbonyl-NG-nitroarginine
  • (2S)-2-[[(tert-Butoxy)carbonyl]amino]-5-(N′-nitrocarbamimidamido)pentanoic acid
  • (2S)-5-[Amino(nitramido)methylidene]azaniumyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
  • (2S)-2-(tert-Butoxycarbonylamino)-5-[(N-nitrocarbamimidoyl)amino]pentanoic acid

Work with N2-[(1,1-Dimethylethoxy)carbonyl]-N5-[imino(nitroamino)methyl]-L-ornithine

Similar compounds

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

Elsewhere