(2S)-1-[2-[[(1S)-1-[[(2S)-6-azanyl-2-(cyclohexylcarbonylamino)hexanoyl]amino]pentyl]-oxidanyl-phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[2-[[(1S)-1-[[(2S)-6-azanyl-2-(cyclohexylcarbonylamino)hexanoyl]amino]pentyl]-oxidanyl-phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[2-[[(1S)-1-[[(2S)-6-amino-2-(cyclohexanecarbonylamino)hexanoyl]amino]pentyl]-hydroxy-phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[2-[[(1S)-1-[[(2S)-6-amino-2-[[cyclohexyl(oxo)methyl]amino]-1-oxohexyl]amino]pentyl]-hydroxyphosphoryl]oxy-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[2-[[(1S)-1-[[(2S)-6-amino-2-(cyclohexanecarbonylamino)hexanoyl]amino]pentyl]-hydroxyphosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[2-[[(1S)-1-[[(2S)-6-amino-2-(cyclohexanecarbonylamino)hexanoyl]amino]pentyl]-hydroxy-phosphoryl]oxypropanoyl]proline Formula: C26H47N4O8P MolecularWeight: 574.647141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(NC(=O)C(CCCCN)NC(=O)C1CCCCC1)P(=O)(O)OC(C)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCCC[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C1CCCCC1)P(=O)(O)OC(C)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C26H47N4O8P/c1-3-4-15-22(39(36,37)38-18(2)25(33)30-17-10-14-21(30)26(34)35)29-24(32)20(13-8-9-16-27)28-23(31)19-11-6-5-7-12-19/h18-22H,3-17,27H2,1-2H3,(H,28,31)(H,29,32)(H,34,35)(H,36,37)/t18?,20-,21-,22-/m0/s1