5-azanyl-2-[2-[[4-methyl-2-[[4-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[[4-methyl-2-[[4-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[2-[[2-[[2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[[4-methyl-2-[[4-methyl-2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-1-oxopentyl]amino]-1-oxopentyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[2-[[4-methyl-2-[[4-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]propanoylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[2-[[2-[[2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-keto-valeric acid Formula: C34H54N6O9 MolecularWeight: 690.82736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(C)C(C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C34H54N6O9/c1-8-21(6)28(40-34(48)49-18-23-12-10-9-11-13-23)32(45)39-26(17-20(4)5)31(44)38-25(16-19(2)3)30(43)36-22(7)29(42)37-24(33(46)47)14-15-27(35)41/h9-13,19-22,24-26,28H,8,14-18H2,1-7H3,(H2,35,41)(H,36,43)(H,37,42)(H,38,44)(H,39,45)(H,40,48)(H,46,47)