4-[[2-[cyclohexyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methyl-pentanoyl]amino]-5-(1H-indol-3-yl)-3-oxidanyl-pentanoic acid

Systemtic Name: 4-[[2-[cyclohexyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methyl-pentanoyl]amino]-5-(1H-indol-3-yl)-3-oxidanyl-pentanoic acid Openeye Name: 4-[[2-[2-(tert-butoxycarbonylamino)propanoyl-cyclohexyl-amino]-3-methyl-pentanoyl]amino]-3-hydroxy-5-(1H-indol-3-yl)pentanoic acid CAS Name: 4-[[2-[cyclohexyl-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-3-methyl-1-oxopentyl]amino]-3-hydroxy-5-(1H-indol-3-yl)pentanoic acid IUPAC Name: 4-[[2-[cyclohexyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxy-5-(1H-indol-3-yl)pentanoic acid Traditional Name: 4-[[2-[2-(tert-butoxycarbonylamino)propanoyl-cyclohexyl-amino]-3-methyl-pentanoyl]amino]-3-hydroxy-5-(1H-indol-3-yl)valeric acid Formula: C33H50N4O7 MolecularWeight: 614.7727

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(CC(=O)O)O)N(C3CCCCC3)C(=O)C(C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(CC(=O)O)O)N(C3CCCCC3)C(=O)C(C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C33H50N4O7/c1-7-20(2)29(37(23-13-9-8-10-14-23)31(42)21(3)35-32(43)44-33(4,5)6)30(41)36-26(27(38)18-28(39)40)17-22-19-34-25-16-12-11-15-24(22)25/h11-12,15-16,19-21,23,26-27,29,34,38H,7-10,13-14,17-18H2,1-6H3,(H,35,43)(H,36,41)(H,39,40)