Basic information
- CAS
1170-76-9- Standard SMILES
O=C(CNC(=O)OCc1ccccc1)NC(Cc1ccccc1)C(=O)O- InChIKey
FLGYJBNDDWLTQR-UHFFFAOYSA-N- Molecular formula
- C19H20N2O5
- Average molar mass
- 356.4 g/mol
- Monoisotopic mass
- 356.13722174
Overview
used as substrate for carboxypeptidase B; RN given refers to (L-Phe)-isomer
Names & identifiers
- Preferred name
- Carbobenzoxyglycylphenylalanine
- IUPAC
- 3-phenyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoic acid
- English name
- Z-Gly-Phe-OH
- Molecular formula
- C19H20N2O5
- Molecular weight
- 356.37
Names & synonyms
CarbobenzoxyglycylphenylalanineCbz-Gly-Phecarbobenzoxy-Gly-PheRefChem:123534Z-GLY-D-PHE-OHN-[(benzyloxy)carbonyl]glycylphenylalanine54885-66-45540-03-42-(2-{[(benzyloxy)carbonyl]amino}acetamido)-3-phenylpropanoic acidMFCD00063161N-Benzyloxycarbonyl-N-GlycylphenylalaninePhenylalanine, N-[(phenylmethoxy)carbonyl]glycyl-
Show more names
Z-GLY-PHECbz-Gly-Phe-OHZ-Gly-Phe-OHCBZ-GLY-L-PHEN-CBZ-GLY-PHECbr-Gly-L-PheZ-Gly-L-Phe-OHCbz-Gly-L-Phe-OHZ-GLY-PHE-OH USP/EP/BP
MFCD00037264N-Cbz-glycyl-L-phenylalanineSCHEMBL330061SCHEMBL10842620FLGYJBNDDWLTQR-UHFFFAOYSA-NALBB-024967NSC89642SGF-3020
Database identifiers
- CAS
1170-76-9、5540-03-4
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 471
Physicochemical properties
- Melting point
- 125 · 125-126 °C
- Boiling point
- 646 · 646.0±55.0 °C(Predicted)
- Density
- 1.278 · 1.278±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 3.54 · 3.54±0.10(Predicted)
- form
- powder
- optical activity
- 20 · [α]20/D +40±1°, c = 2.5% in ethanol
- BRN
- 2182728 · 2182728
- Major Application
- peptide synthesis
- InChI
- 1S/C19H20N2O5/c22-17(12-20-19(25)26-13-15-9-5-2-6-10-15)21-16(18(23)24)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,20,25)(H,21,22)(H,23,24)/t16-/m0/s1
- InChIKey
- FLGYJBNDDWLTQR-INIZCTEOSA-N
- SMILES
- OC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)OCc2ccccc2
- CAS DataBase Reference
- 1170 · 1170-76-9(CAS DataBase Reference)
- UNSPSC Code
- 12352200 · 12352200
- NACRES
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Storage Class
- 13 - Non Combustible Solids
Chemistry & industry
Applications
UsesSubstrate for carboxypeptidase A.
Upstream & downstream products
Downstream products
Suppliers46 total
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]
上海嘉莱多生物技术有限责任公司021-61732478 19946252459 · [email protected]
河南英田生物科技有限公司0370-4053511; 18339993703 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.
Related reactions
4 records
Compound notes
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