6-azanyl-2-[[2-methyl-1-(4-oxidanylbutanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-methyl-1-(4-oxidanylbutanoylamino)propyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[hydroxy-[1-(4-hydroxybutanoylamino)-2-methyl-propyl]phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[hydroxy-[1-[(4-hydroxy-1-oxobutyl)amino]-2-methylpropyl]phosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[hydroxy-[1-(4-hydroxybutanoylamino)-2-methylpropyl]phosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[hydroxy-[1-(4-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)CCCO)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H29N2O7P/c1-10(2)13(16-12(18)7-5-9-17)24(21,22)23-11(14(19)20)6-3-4-8-15/h10-11,13,17H,3-9,15H2,1-2H3,(H,16,18)(H,19,20)(H,21,22)