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Compound
Boc-Gly-(1).Cbz-DL-Lys(1)-OH
HCID
175496366
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Basic information
Standard SMILES
CC(C)(C)OC(=O)NCC(=O)NCCCCC(NC(=O)OCc1ccccc1)C(=O)O
InChIKey
JXDJEUVAYLTUHU-UHFFFAOYSA-N
Molecular formula
C21H31N3O7
Average molar mass
437.5 g/mol
Monoisotopic mass
437.21620034
Names & identifiers
Preferred name
Boc-Gly-(1).Cbz-DL-Lys(1)-OH
IUPAC
6-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid
Names & synonyms
SCHEMBL29119136
Database identifiers
PubChem CID
175496366
Properties
Computed structural properties
XLogP
2.2
Topological polar surface area
143 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
7
Rotatable bonds
14
Heavy atoms
31
Formal charge
0
Complexity
598
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Related reactions
1 records
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As reactant
As product
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As solvent
HRID
1240816
As product
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Compound notes
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