Boc-N-Me-Tyr(Bzl)-OH
Basic information
- CAS
64263-81-6- Standard SMILES
CN(C(=O)OC(C)(C)C)[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)O- InChIKey
FSNRGORPOYPIJC-IBGZPJMESA-N- Molecular formula
- C22H27NO5
- Average molar mass
- 385.5 g/mol
- Monoisotopic mass
- 385.18892296
Names & identifiers
- Preferred name
- Boc-N-Me-Tyr(Bzl)-OH
- IUPAC
- (2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid
- English name
- Boc-N-alpha-methyl-O-benzyl-L-tyrosine
- Molecular formula
- C22H27NO5
- Molecular weight
- 385.45
Names & synonyms
Boc-N-Me-Tyr(Bzl)-OH64263-81-6Boc-N-alpha-methyl-O-benzyl-L-tyrosineBoc-N-methyl-O-benzyl-L-tyrosineMFCD00038755(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acidM03332(S)-3-(4-(Benzyloxy)phenyl)-2-((tert-butoxycarbonyl)(methyl)amino)propanoic acidBOC-METYR(BZL)-OHBoc-N-|A-methyl-O-benzyl-L-tyrosineL-Tyrosine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-O-(phenylmethyl)-O-Benzyl-N-(tert-butoxycarbonyl)-N-methyl-L-tyrosine
Show more names
Boc-N-me-Tyr(Bzl)BOC-L-METYR(BZL)-OHBoc-N-Me-Thr(Bzl)-OHBoc-N-Me-L-Tyr(Bzl)-OHBOc-N-Me-L-Tyr(Bz1)-OHBOC-N-ME-TYROSINE(BZL)-OHBOC-O-METHYLBENZYL-L-TYROSINE
Boc-NMe-Tyr(OBn)-OHMETHYL-N-BOC-4-BENZYLOXY-L-PHENYL ALANINESCHEMBL6474783FSNRGORPOYPIJC-IBGZPJMESA-NDTXSID701157091N-Boc-N-methyl-O-benzyl-L-tyrosine(2S)-3-(4-benzyloxyphenyl)-2-[tert-butoxycarbonyl(methyl)amino]propanoic acidAKOS015836710
Database identifiers
- CAS
64263-81-6- PubChem CID
- 7010604
- DTXSID
DTXSID701157091- Nikkaji
- J1.095.565C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 502
Physicochemical properties
- Melting point
- 130 · 130-134 °C
- Boiling point
- 533 · 533.0±50.0 °C(Predicted)
- Density
- 1.174 · 1.174±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Powder
- pka
- 3 · 3.00±0.10(Predicted)
- InChI
- InChI=1S/C22H27NO5/c1-22(2,3)28-21(26)23(4)19(20(24)25)14-16-10-12-18(13-11-16)27-15-17-8-6-5-7-9-17/h5-13,19H,14-15H2,1-4H3,(H,24,25)/t19-/m0/s1
- InChIKey
- FSNRGORPOYPIJC-IBGZPJMESA-N
- SMILES
- C(O)(=O)[C@H](CC1=CC=C(OCC2=CC=CC=C2)C=C1)N(C(OC(C)(C)C)=O)C
- CAS DataBase Reference
- 64263 · 64263-81-6(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesBoc-N-methyl-O-benzyl-L-tyrosine is used in total synthesis of marine-derived elastase inhibitor lyngbyastatin 7, and its evaluation of in vitro antiproteolytic activity against porcine pancreatic elastase as reactant/reagent.
Suppliers
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Related reactions
5 records
Compound notes
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