IUPAC Name: | benzyl (2S)-3-(3-iodo-4-phenylmethoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate |
Description: | 3-Iodo-N-[(benzyloxy)carbonyl]-O-benzyl-L-tyrosine Benzyl Ester is a reactant used in the preparation of Dityrosine, Trityrosine, and Pulcherosine. |
Molecular Weight: | 621.46 |
Molecular Formula: | C31H28INO5 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)I |
InChI: | InChI=1S/C31H28INO5/c32-27-18-26(16-17-29(27)36-20-23-10-4-1-5-11-23)19-28(30(34)37-21-24-12-6-2-7-13-24)33-31(35)38-22-25-14-8-3-9-15-25/h1-18,28H,19-22H2,(H,33,35)/t28-/m0/s1 |
InChI Key: | SKKRRRPVGNIWKT-NDEPHWFRSA-N |
Solubility: | Dichloromethane |
Appearance: | Pale Yellow Solid |
References: | Skaff, O. et al. J. Org. Chem., 70, 7353 (2005); Hutton, C. & Skaff, O. Tetrahedron Lett., 44, 4895 (2003). |
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