PCJ

(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-1,2-DIYL DIHEXADECANOATE


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Chemical Component Summary

Name(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-1,2-DIYL DIHEXADECANOATE
Identifiers[(2R)-3-[(2S)-2-(hexadecanoylamino)-3-hydroxy-propyl]sulfanyl-2-hexadecanoyloxy-propyl] hexadecanoate
FormulaC54 H105 N O6 S
Molecular Weight896.48
TypeNON-POLYMER
Isomeric SMILESCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)CSC[C@@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C54H105NO6S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-52(57)55-50(46-56)48-62-49-51(61-54(59)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-60-53(58)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h50-51,56H,4-49H2,1-3H3,(H,55,57)/t50-,51+/m0/s1
InChIKeyGBQDHEZHWNJSLG-OKPYTHRESA-N

Chemical Details

Formal Charge0
Atom Count167
Chiral Atom Count2
Bond Count166
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 49867479