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Basic information
- CAS
34404-36-9- Standard SMILES
CC(C)(C)OC(=O)NC(CCCCNC(=O)OCc1ccccc1)C(=O)ON1C(=O)CCC1=O- InChIKey
YWLICOCXPNQJPC-UHFFFAOYSA-N- Molecular formula
- C23H31N3O8
- Average molar mass
- 477.5 g/mol
- Monoisotopic mass
- 477.21111496
Names & identifiers
- Preferred name
- Benzyl (S)-(5-(((1,1-dimethylethoxy)carbonyl)amino)-6-((2,5-dioxo-1-pyrrolidinyl)oxy)-6-oxohexyl)carbamate
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate
- English name
- Boc-Lys(Z)-OSu
- Molecular formula
- C23H31N3O8
- Molecular weight
- 477.51
Names & synonyms
EINECS 251-999-7Benzyl (S)-(5-(((1,1-dimethylethoxy)carbonyl)amino)-6-((2,5-dioxo-1-pyrrolidinyl)oxy)-6-oxohexyl)carbamateBenzyl (S)-[5-[[(1,1-dimethylethoxy)carbonyl]amino]-6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]carbamateRefChem:328389251-999-734404-36-9SCHEMBL356734DTXSID30955953(2,5-dioxopyrrolidin-1-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoatePD196563N|A-Boc-N|A-Z-L-lysine hydroxysuccinimide esterN|A-Boc-N|A-Cbz-L-lysine N-hydroxysuccinimide ester
Show more names
Boc-Lys(Z)-OsucBoc-L-Lys(Z)-OSuBoc-L-Lys(Cbz)-OSu(Tert-Butoxy)Carbonyl Lys(Z)-OSuNA-BOC-NE-CBZ-L-LYSINEHYDROXYSUCCINIMIDEESTERNα-Boc-Nε-Z-L-lysine hydroxysuccinimide esterNε-Z-Nα-Boc-L-lysine hydroxysuccinimide esterNα-Boc-Nε-Z-L-lysine N-hydroxysuccinimide esternα-boc-nε-cbz-l-lysine n-hydroxysuccinimide ester
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 14
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 727
Physicochemical properties
- Melting point
- 110 · 110-120 °C
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- pka
- 10.76 · 10.76±0.46(Predicted)
- form
- Powder
- color
- White
- optical activity
- 20 · [α]20/D -21.0±1.5°, c = 2% in dioxane
- Water Solubility
- Slightly soluble in water.
- BRN
- 1559393 · 1559393
- Major Application
- peptide synthesis
- InChIKey
- YWLICOCXPNQJPC-KRWDZBQOSA-N
- SMILES
- CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)ON2C(=O)CCC2=O
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 22 · NA.22
- Symbol(GHS)
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
- 3-10-21
- wgk
- 3
- hs_code
- 29280000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesNepsilon-Benzyloxycarbonyl-Nalpha-Boc-L-lysine N-succinimidyl ester is a reactant involved in Cellular labeling and tumor MRI as a bimodal lipidic contrast agent, Synthesis of improved peptide prodrugs 5-ALA for photodynamic therapy, Design of high affinity peptide conjugates as markers for small peptide transporter PEPT1 (SLC15A1), Preparation of human growth hormone derivatives containing PEG groups, Enantiodivergent asymmetric cyclization and Solid-phase synthesis of peptide-cationic steroid conjugates for antibacterial screening.
UsesReactant involved in:Cellular labeling and tumor MRI as a bimodal lipidic contrast agentSynthesis of improved peptide prodrugs 5-ALA for photodynamic therapyDesign of high affinity peptide conjugates as markers for small peptide transporter PEPT1 (SLC15A1)Preparation of human growth hormone derivatives containing PEG groupsEnantiodivergent asymmetric cyclizationSolid-phase synthesis of peptide-cationic steroid conjugates for antibacterial screening
Suppliers74 total
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Hangzhou Go Top Peptide Biotech0571-88211921 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
Related reactions
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Compound notes
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