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methyl 3-[3-(hexadecanoylamino)-2-oxidanyl-propyl]sulfanylpropanoate

methyl 3-[3-(hexadecanoylamino)-2-oxidanyl-propyl]sulfanylpropanoate

Systemtic Name:methyl 3-[3-(hexadecanoylamino)-2-oxidanyl-propyl]sulfanylpropanoate
Openeye Name:methyl 3-[3-(hexadecanoylamino)-2-hydroxy-propyl]sulfanylpropanoate
CAS Name:3-[[2-hydroxy-3-(1-oxohexadecylamino)propyl]thio]propanoic acid methyl ester
IUPAC Name:methyl 3-[3-(hexadecanoylamino)-2-hydroxypropyl]sulfanylpropanoate
Traditional Name:3-[(2-hydroxy-3-palmitamido-propyl)thio]propionic acid methyl ester
Formula: C23H45NO4S
MolecularWeight: 431.6727
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCC(CSCCC(=O)OC)O


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCC(CSCCC(=O)OC)O


InChI

InChI=1S/C23H45NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22(26)24-19-21(25)20-29-18-17-23(27)28-2/h21,25H,3-20H2,1-2H3,(H,24,26)


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