(2R)-2-(dodecanoylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-(dodecanoylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-(dodecanoylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-propanoic acid CAS Name: (2R)-2-(1-oxododecylamino)-3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]propanoic acid IUPAC Name: (2R)-2-(dodecanoylamino)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylpropanoic acid Traditional Name: (2R)-2-(lauroylamino)-3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]propionic acid Formula: C30H53NO3S MolecularWeight: 507.81172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CSCC=C(C)CCC=C(C)CCC=C(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@@H](CSC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)C(=O)O

InChI

InChI=1S/C30H53NO3S/c1-6-7-8-9-10-11-12-13-14-21-29(32)31-28(30(33)34)24-35-23-22-27(5)20-16-19-26(4)18-15-17-25(2)3/h17,19,22,28H,6-16,18,20-21,23-24H2,1-5H3,(H,31,32)(H,33,34)/b26-19+,27-22+/t28-/m0/s1