11-[[(2S)-2-(dodecanoylamino)-4-methyl-pentanoyl]amino]undecanoic acid

Systemtic Name: 11-[[(2S)-2-(dodecanoylamino)-4-methyl-pentanoyl]amino]undecanoic acid Openeye Name: 11-[[(2S)-2-(dodecanoylamino)-4-methyl-pentanoyl]amino]undecanoic acid CAS Name: 11-[[(2S)-4-methyl-1-oxo-2-(1-oxododecylamino)pentyl]amino]undecanoic acid IUPAC Name: 11-[[(2S)-2-(dodecanoylamino)-4-methylpentanoyl]amino]undecanoic acid Traditional Name: 11-[[(2S)-2-(lauroylamino)-4-methyl-pentanoyl]amino]undecanoic acid Formula: C29H56N2O4 MolecularWeight: 496.76594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CC(C)C)C(=O)NCCCCCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@@H](CC(C)C)C(=O)NCCCCCCCCCCC(=O)O

InChI

InChI=1S/C29H56N2O4/c1-4-5-6-7-8-9-12-15-18-21-27(32)31-26(24-25(2)3)29(35)30-23-20-17-14-11-10-13-16-19-22-28(33)34/h25-26H,4-24H2,1-3H3,(H,30,35)(H,31,32)(H,33,34)/t26-/m0/s1