6-azanyl-2-[[2-methyl-1-(3-oxidanylbutanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-methyl-1-(3-oxidanylbutanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[hydroxy-[1-(3-hydroxybutanoylamino)-2-methyl-propyl]phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[hydroxy-[1-[(3-hydroxy-1-oxobutyl)amino]-2-methylpropyl]phosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[hydroxy-[1-(3-hydroxybutanoylamino)-2-methylpropyl]phosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[hydroxy-[1-(3-hydroxybutanoylamino)-2-methyl-propyl]phosphoryl]oxy-hexanoic acid Formula: C14H29N2O7P MolecularWeight: 368.363021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)CC(C)O)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

CC(C)C(NC(=O)CC(C)O)P(=O)(O)OC(CCCCN)C(=O)O

InChI

InChI=1S/C14H29N2O7P/c1-9(2)13(16-12(18)8-10(3)17)24(21,22)23-11(14(19)20)6-4-5-7-15/h9-11,13,17H,4-8,15H2,1-3H3,(H,16,18)(H,19,20)(H,21,22)