(4S)-4-acetamido-5-[2,3-di(dodecanoyloxy)propoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-acetamido-5-[2,3-di(dodecanoyloxy)propoxy]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-acetamido-5-[2,3-di(dodecanoyloxy)propoxy]-5-oxo-pentanoic acid CAS Name: (4S)-4-acetamido-5-[2,3-bis(1-oxododecoxy)propoxy]-5-oxopentanoic acid IUPAC Name: (4S)-4-acetamido-5-[2,3-di(dodecanoyloxy)propoxy]-5-oxopentanoic acid Traditional Name: (4S)-4-acetamido-5-(2,3-dilauroyloxypropoxy)-5-keto-valeric acid Formula: C34H61NO9 MolecularWeight: 627.84944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COC(=O)C(CCC(=O)O)NC(=O)C)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COC(=O)[C@H](CCC(=O)O)NC(=O)C)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C34H61NO9/c1-4-6-8-10-12-14-16-18-20-22-32(39)42-26-29(27-43-34(41)30(35-28(3)36)24-25-31(37)38)44-33(40)23-21-19-17-15-13-11-9-7-5-2/h29-30H,4-27H2,1-3H3,(H,35,36)(H,37,38)/t29?,30-/m0/s1