![N,N,N'-TRIS-[(N(ALPHA)-2-CHLOROBENZYLOXYCARBONYL)-L-LYSIL-3-AMINOPROPYL]-L-DIAMINOALANINE-BENZYLAMIDE-PENTAHYDROCHLORIDE](/api/spectrum/GcBi2SHJU2L/structure.png?h=300&w=458 "N,N,N'-TRIS-[(N(ALPHA)-2-CHLOROBENZYLOXYCARBONYL)-L-LYSIL-3-AMINOPROPYL]-L-DIAMINOALANINE-BENZYLAMIDE-PENTAHYDROCHLORIDE")
| SpectraBase Compound ID | 2mDZnLChEDb |
|---|---|
| InChI | InChI=1S/C61H87Cl3N12O10.5ClH/c62-48-24-7-4-21-45(48)41-84-59(81)73-51(27-10-13-30-65)55(77)69-34-16-33-68-54(58(80)72-39-44-19-2-1-3-20-44)40-76(37-17-35-70-56(78)52(28-11-14-31-66)74-60(82)85-42-46-22-5-8-25-49(46)63)38-18-36-71-57(79)53(29-12-15-32-67)75-61(83)86-43-47-23-6-9-26-50(47)64;;;;;/h1-9,19-26,51-54,68H,10-18,27-43,65-67H2,(H,69,77)(H,70,78)(H,71,79)(H,72,80)(H,73,81)(H,74,82)(H,75,83);5*1H/t51-,52-,53-,54-;;;;;/m0...../s1 |
| InChIKey | CBIWIAVBBVMJHC-MFYGWZJTSA-N |
| Mol Weight | 1437.1 g/mol |
| Molecular Formula | C61H92Cl8N12O10 |
| Exact Mass | 1432.456759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GcBi2SHJU2L |
|---|---|
| Name | N,N,N'-TRIS-[(N(ALPHA)-2-CHLOROBENZYLOXYCARBONYL)-L-LYSIL-3-AMINOPROPYL]-L-DIAMINOALANINE-BENZYLAMIDE-PENTAHYDROCHLORIDE |
| Compound Number | 7E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H92Cl8N12O10 |
| InChI | InChI=1S/C61H87Cl3N12O10.5ClH/c62-48-24-7-4-21-45(48)41-84-59(81)73-51(27-10-13-30-65)55(77)69-34-16-33-68-54(58(80)72-39-44-19-2-1-3-20-44)40-76(37-17-35-70-56(78)52(28-11-14-31-66)74-60(82)85-42-46-22-5-8-25-49(46)63)38-18-36-71-57(79)53(29-12-15-32-67)75-61(83)86-43-47-23-6-9-26-50(47)64;;;;;/h1-9,19-26,51-54,68H,10-18,27-43,65-67H2,(H,69,77)(H,70,78)(H,71,79)(H,72,80)(H,73,81)(H,74,82)(H,75,83);5*1H/t51-,52-,53-,54-;;;;;/m0...../s1 |
| InChIKey | CBIWIAVBBVMJHC-MFYGWZJTSA-N |
| Literature Reference Author | P.POLCYN,M.JURCZAK,A.RAJNISZ,J.SOLECKA,Z.URBANCZYK-LIPKOWSKA |
| Literature Reference Citation | MOLECULES,14,3881(2009) |
| Literature Reference DOI | 10.3390/molecules14103881 |
| Molecular Weight | 1437.100 g/mol |
| Sample ID | 69828 |
| Solvent | Unknown |