[(2S)-2-oxidanyl-2-(5-oxidanyl-3-oxidanylidene-4-phosphonooxy-furan-2-yl)ethyl] 2-hexylundecanoate

Systemtic Name: [(2S)-2-oxidanyl-2-(5-oxidanyl-3-oxidanylidene-4-phosphonooxy-furan-2-yl)ethyl] 2-hexylundecanoate Openeye Name: [(2S)-2-hydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxy-2-furyl)ethyl] 2-hexylundecanoate CAS Name: 2-hexylundecanoic acid [(2S)-2-hydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxy-2-furanyl)ethyl] ester IUPAC Name: [(2S)-2-hydroxy-2-(5-hydroxy-3-oxo-4-phosphonooxyfuran-2-yl)ethyl] 2-hexylundecanoate Traditional Name: 2-hexylundecanoic acid [(2S)-2-hydroxy-2-(5-hydroxy-3-keto-4-phosphonooxy-2-furyl)ethyl] ester Formula: C23H41O10P MolecularWeight: 508.539401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCC)C(=O)OCC(C1C(=O)C(=C(O1)O)OP(=O)(O)O)O

Isomeric SMILES

CCCCCCCCCC(CCCCCC)C(=O)OC[C@@H](C1C(=O)C(=C(O1)O)OP(=O)(O)O)O

InChI

InChI=1S/C23H41O10P/c1-3-5-7-9-10-11-13-15-17(14-12-8-6-4-2)22(26)31-16-18(24)20-19(25)21(23(27)32-20)33-34(28,29)30/h17-18,20,24,27H,3-16H2,1-2H3,(H2,28,29,30)/t17?,18-,20?/m0/s1