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N-[(2’-(N2-Trityltetrazol[1,1’-biphenyl]-4-yl)methyl]-N-[3-(2-methyl-1,3-dioxolan-2-yl)-1-oxopropyl]
For research use only. Not for therapeutic Use.
Catalog Number | R009051 |
CAS Number | 1798904-60-5 |
Synonyms | (S)-2-{2’-(N2-Trityltetrazolbiphenyl-4-ylmethyl)-[3-(2-methyl-1,3-dioxolan-2-yl)propionyl]amino-3-methylbutyric Acid Benzyl Ester; |
Molecular Formula | C52H51N5O5 |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | benzyl (2S)-3-methyl-2-[3-(2-methyl-1,3-dioxolan-2-yl)propanoyl-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoate |
InChI | InChI=1S/C52H51N5O5/c1-38(2)48(50(59)60-37-40-18-8-4-9-19-40)56(47(58)32-33-51(3)61-34-35-62-51)36-39-28-30-41(31-29-39)45-26-16-17-27-46(45)49-53-55-57(54-49)52(42-20-10-5-11-21-42,43-22-12-6-13-23-43)44-24-14-7-15-25-44/h4-31,38,48H,32-37H2,1-3H3/t48-/m0/s1 |
InChIKey | YJHKQPGYJIVMDL-DYVQZXGMSA-N |
SMILES | CC(C)C(C(=O)OCC1=CC=CC=C1)N(CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN(N=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)CCC8(OCCO8)C |