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Boc-Gly-(1).Cbz-DL-Lys(1)-OH

HCID 175496366
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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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

Related reactions

1 records
New reaction record
HRID 1240816 reaction equation
HRID 1240816As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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