S-[(2S)-2-butanoylsulfanyl-3-[methoxy(oxidanyl)phosphoryl]oxy-propyl] nonanethioate

Systemtic Name: S-[(2S)-2-butanoylsulfanyl-3-[methoxy(oxidanyl)phosphoryl]oxy-propyl] nonanethioate Openeye Name: S-[(2S)-2-butanoylsulfanyl-3-[hydroxy(methoxy)phosphoryl]oxy-propyl] nonanethioate CAS Name: nonanethioic acid S-[(2S)-3-[hydroxy(methoxy)phosphoryl]oxy-2-(1-oxobutylthio)propyl] ester IUPAC Name: S-[(2S)-2-butanoylsulfanyl-3-[hydroxy(methoxy)phosphoryl]oxypropyl] nonanethioate Traditional Name: nonanethioic acid S-[(2S)-2-(butyrylthio)-3-[hydroxy(methoxy)phosphoryl]oxy-propyl] ester Formula: C17H33O6PS2 MolecularWeight: 428.544081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)SCC(COP(=O)(O)OC)SC(=O)CCC

Isomeric SMILES

CCCCCCCCC(=O)SC[C@H](COP(=O)(O)OC)SC(=O)CCC

InChI

InChI=1S/C17H33O6PS2/c1-4-6-7-8-9-10-12-16(18)25-14-15(26-17(19)11-5-2)13-23-24(20,21)22-3/h15H,4-14H2,1-3H3,(H,20,21)/t15-/m0/s1