Boc-Ile-.delta.Phe-Trp

Molecular Formula: C₃₁H₃₈N₄O₆

InChI: InChI=1/C31H38N4O6/c1-6-19(2)26(35-30(40)41-31(3,4)5)28(37)33-24(16-20-12-8-7-9-13-20)27(36)34-25(29(38)39)17-21-18-32-23-15-11-10-14-22(21)23/h7-16,18-19,25-26,32H,6,17H2,1-5H3,(H,33,37)(H,34,36)(H,35,40)(H,38,39)/b24-16+/t19-,25-,26-/m0/s1/f/h33-35,38H

InChIKey: InChIKey=QTVZNMOJALRMKI-MEPAHOAZDA
SMILES: CCC(C)C(C(=O)NC(=CC1=CC=CC=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)NC(=O)OC(C)(C)C

Names:
    AIDS-123607
    AIDS123607
    Boc-Ile-.delta.Phe-Trp
    N-((2E)-2-{[N-(tert-Butoxycarbonyl)-L-isoleucyl]amino
    (2S)-3-(1H-indol-3-yl)-2-[[(E)-2-[[(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-phenyl-prop-2-enoyl]amino]propanoic acid

Registries:
    PubChem CID 6476985
    PubChem ID 219735