2-[[1-[[2-[[3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butyl]-oxidanyl-phosphoryl]ethanoic acid

Systemtic Name: 2-[[1-[[2-[[3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butyl]-oxidanyl-phosphoryl]ethanoic acid Openeye Name: 2-[[1-[[2-[[2-(benzyloxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butyl]-hydroxy-phosphoryl]acetic acid CAS Name: 2-[[1-[[2-[[3,3-dimethyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-3-methyl-1-oxopentyl]amino]-3-methylbutyl]-hydroxyphosphoryl]acetic acid IUPAC Name: 2-[[1-[[2-[[3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutyl]-hydroxyphosphoryl]acetic acid Traditional Name: 2-[[1-[[2-[[2-(benzyloxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butyl]-hydroxy-phosphoryl]acetic acid Formula: C27H44N3O8P MolecularWeight: 569.627321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44N3O8P/c1-8-18(4)22(24(33)28-20(14-17(2)3)39(36,37)16-21(31)32)29-25(34)23(27(5,6)7)30-26(35)38-15-19-12-10-9-11-13-19/h9-13,17-18,20,22-23H,8,14-16H2,1-7H3,(H,28,33)(H,29,34)(H,30,35)(H,31,32)(H,36,37)