2-(hexadecylamino)-3-[[2-(hexadecylamino)-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid

Systemtic Name: 2-(hexadecylamino)-3-[[2-(hexadecylamino)-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid Openeye Name: 2-(hexadecylamino)-3-[[2-(hexadecylamino)-3-hydroxy-3-oxo-propyl]disulfanyl]propanoic acid CAS Name: 2-(hexadecylamino)-3-[[2-(hexadecylamino)-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid IUPAC Name: 2-(hexadecylamino)-3-[[2-(hexadecylamino)-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid Traditional Name: 2-(cetylamino)-3-[[2-(cetylamino)-3-hydroxy-3-keto-propyl]disulfanyl]propionic acid Formula: C38H76N2O4S2 MolecularWeight: 689.15104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(CSSCC(C(=O)O)NCCCCCCCCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(CSSCC(C(=O)O)NCCCCCCCCCCCCCCCC)C(=O)O

InChI

InChI=1S/C38H76N2O4S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-39-35(37(41)42)33-45-46-34-36(38(43)44)40-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39-40H,3-34H2,1-2H3,(H,41,42)(H,43,44)