L-Ornithine, N5-(imino(((4-methoxy-2,3,6-trimethylphenyl)sulfonyl)amino)methyl)-N2-((phenylmethoxy)carbonyl)-, compd. with cyclohexanamine (1:1)
Basic information
- CAS
80745-09-1- Standard SMILES
COc1cc(C)c(S(=O)(=O)NC(N)=NCCC[C@H](NC(=O)OCc2ccccc2)C(=O)O)c(C)c1C.NC1CCCCC1- InChIKey
MDRGEGBEEQDQPG-FYZYNONXSA-N- Molecular formula
- C30H45N5O7S
- Average molar mass
- 619.8 g/mol
- Monoisotopic mass
- 619.30396997
Overview
See other relationships...
Names & identifiers
- Preferred name
- L-Ornithine, N5-(imino(((4-methoxy-2,3,6-trimethylphenyl)sulfonyl)amino)methyl)-N2-((phenylmethoxy)carbonyl)-, compd. with cyclohexanamine (1:1)
- IUPAC
- (2S)-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-2-(phenylmethoxycarbonylamino)pentanoic acid;cyclohexanamine
- English name
- Z-Arg(Mtr)-OH cha
- Molecular formula
- C30H45N5O7S
- Molecular weight
- 619.77
Names & synonyms
L-Ornithine, N5-(imino(((4-methoxy-2,3,6-trimethylphenyl)sulfonyl)amino)methyl)-N2-((phenylmethoxy)carbonyl)-, compd. with cyclohexanamine (1:1)L-Ornithine, N5-[imino[[(4-methoxy-2,3,6-trimethylphenyl)sulfonyl]amino]methyl]-N2-[(phenylmethoxy)carbonyl]-, compd. with cyclohexanamine (1:1)RefChem:79734480745-09-1Z-Arg(Mtr)-OH.CHAZ-Arg(Mtr)-OH CHAMFCD00057997Cbz-Arg(Mtr)-OH.CHA(2S)-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-2-(phenylmethoxycarbonylamino)pentanoic acid;cyclohexanamineC30H45N5O7SN-alpha-BenZyloxycarbonyl-N'-(4-methoxy-2,3,6-trimethylphenyl-sulfonyl)-L-arginine cyclohexylamine (CbZ-L-Arg(Mtr)-OH.CHA)AMY22603
Show more names
Z-Arg(Mtr)-OHCBZ-Arg(Mtr)-OH·CHAZ-L-Arg(Mtr)-OH*CHAZ-Arg(Mtr)-OH·Z-L-ARG(MTR)-OH X CHAZ-ARGININE(MTR)-OH CHAZ-Arg(Mtr)-OH·CHA, 98.0%Z-ARG(MTR)-OH CHA USP/EP/BP
Properties
Computed structural properties
- Topological polar surface area
- 204 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 901
Physicochemical properties
- Melting point
- 196 · 196-199°C
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- 1 % · Soluble in water or 1% acetic acid
- form
- Powder
- BRN
- 5713370 · 5713370
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-21
- wgk
- 3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…