2-[1-(6-cycloheptyl-9-sulfanyl-octadecan-9-yl)oxypropoxy]-2-oxidanyl-2-phosphoroso-ethanoic acid

Systemtic Name: 2-[1-(6-cycloheptyl-9-sulfanyl-octadecan-9-yl)oxypropoxy]-2-oxidanyl-2-phosphoroso-ethanoic acid Openeye Name: 2-[1-[1-(3-cycloheptyloctyl)-1-sulfanyl-decoxy]propoxy]-2-hydroxy-2-phosphoroso-acetic acid CAS Name: 2-[1-(6-cycloheptyl-9-mercaptooctadecan-9-yl)oxypropoxy]-2-hydroxy-2-phosphorosoacetic acid IUPAC Name: 2-[1-(6-cycloheptyl-9-sulfanyloctadecan-9-yl)oxypropoxy]-2-hydroxy-2-phosphorosoacetic acid Traditional Name: 2-[1-[1-(3-cycloheptyloctyl)-1-mercapto-decoxy]propoxy]-2-hydroxy-2-phosphoroso-acetic acid Formula: C30H57O6PS MolecularWeight: 576.808741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCC(CCCCC)C1CCCCCC1)(OC(CC)OC(C(=O)O)(O)P=O)S

Isomeric SMILES

CCCCCCCCCC(CCC(CCCCC)C1CCCCCC1)(OC(CC)OC(C(=O)O)(O)P=O)S

InChI

InChI=1S/C30H57O6PS/c1-4-7-9-10-11-14-18-23-29(38,35-27(6-3)36-30(33,37-34)28(31)32)24-22-26(19-15-8-5-2)25-20-16-12-13-17-21-25/h25-27,33,38H,4-24H2,1-3H3,(H,31,32)