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N-(((Phenylmethoxy)carbonyl)glycyl)-L-isoleucine

HCID 89391
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Basic information

CAS
20807-11-8
Standard SMILES
CCC(C)C(NC(=O)CNC(=O)OCc1ccccc1)C(=O)O
InChIKey
YPXHSERXWVIZGK-UHFFFAOYSA-N
Molecular formula
C16H22N2O5
Average molar mass
322.36 g/mol
Monoisotopic mass
322.15287181

Names & identifiers

Preferred name
N-(((Phenylmethoxy)carbonyl)glycyl)-L-isoleucine
IUPAC
3-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]pentanoic acid
English name
Z-Gly-Ile-OH
Molecular formula
C16H22N2O5
Molecular weight
322.36

Names & synonyms

Z-GLY-ILE-OH((Benzyloxy)carbonyl)glycyl-L-isoleucineEINECS 244-050-3NSC169146N-(((Phenylmethoxy)carbonyl)glycyl)-L-isoleucineSCHEMBL23086208DTXSID40943028YPXHSERXWVIZGK-UHFFFAOYSA-NNSC-169146FG111475DB-045390N-(2-{[(Benzyloxy)(hydroxy)methylidene]amino}-1-hydroxyethylidene)isoleucine
Show more names
Z-GLY-ILEN-cbz-gly-ileZ-Gly-L-Ile-OHCbz-Gly-Ile-OHZ-GLYCYL-L-ISOLEUCINEN-carbobenzyloxy-Gly-IleN-CARBOBENZOXY-GLYCYL-L-ISOLEUCINEN-BENZYLOXYCARBONYLGLYCYL-L-ISOLEUCINE

Database identifiers

CAS
20807-11-8
PubChem CID
89391
DTXSID
DTXSID40943028

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
105 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
23
Formal charge
0
Complexity
407

Physicochemical properties

storage temp.
20 °C · −20°C
WGK Germany
3 · 3

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

wgk
3

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