(2R)-3-[(2-azanyl-3-hexadecanoyloxy-3-oxidanylidene-propyl)disulfanyl]-2-(hexadecanoylamino)propanoic acid

Systemtic Name: (2R)-3-[(2-azanyl-3-hexadecanoyloxy-3-oxidanylidene-propyl)disulfanyl]-2-(hexadecanoylamino)propanoic acid Openeye Name: (2R)-3-[(2-amino-3-hexadecanoyloxy-3-oxo-propyl)disulfanyl]-2-(hexadecanoylamino)propanoic acid CAS Name: (2R)-3-[[2-amino-3-oxo-3-(1-oxohexadecoxy)propyl]disulfanyl]-2-(1-oxohexadecylamino)propanoic acid IUPAC Name: (2R)-3-[(2-amino-3-hexadecanoyloxy-3-oxopropyl)disulfanyl]-2-(hexadecanoylamino)propanoic acid Traditional Name: (2R)-3-[(2-amino-3-hexadecanoyloxy-3-keto-propyl)disulfanyl]-2-palmitamido-propionic acid Formula: C38H72N2O6S2 MolecularWeight: 717.11808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CSSCC(C(=O)OC(=O)CCCCCCCCCCCCCCC)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H](CSSCC(C(=O)OC(=O)CCCCCCCCCCCCCCC)N)C(=O)O

InChI

InChI=1S/C38H72N2O6S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35(41)40-34(37(43)44)32-48-47-31-33(39)38(45)46-36(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34H,3-32,39H2,1-2H3,(H,40,41)(H,43,44)/t33?,34-/m0/s1