[2-[(2-fluoranyl-3-oxidanyl-tetradecanoyl)amino]-5,6-bis(oxidanyl)-1-oxidanylidene-4-phosphonooxy-hexan-3-yl] 3-oxidanyltetradecanoate

Systemtic Name: [2-[(2-fluoranyl-3-oxidanyl-tetradecanoyl)amino]-5,6-bis(oxidanyl)-1-oxidanylidene-4-phosphonooxy-hexan-3-yl] 3-oxidanyltetradecanoate Openeye Name: [1-[1-[(2-fluoro-3-hydroxy-tetradecanoyl)amino]-2-oxo-ethyl]-3,4-dihydroxy-2-phosphonooxy-butyl] 3-hydroxytetradecanoate CAS Name: 3-hydroxytetradecanoic acid [2-[(2-fluoro-3-hydroxy-1-oxotetradecyl)amino]-5,6-dihydroxy-1-oxo-4-phosphonooxyhexan-3-yl] ester IUPAC Name: [2-[(2-fluoro-3-hydroxytetradecanoyl)amino]-5,6-dihydroxy-1-oxo-4-phosphonooxyhexan-3-yl] 3-hydroxytetradecanoate Traditional Name: 3-hydroxymyristic acid [1-[1-[(2-fluoro-3-hydroxy-tetradecanoyl)amino]-2-keto-ethyl]-3,4-dihydroxy-2-phosphonooxy-butyl] ester Formula: C34H65FNO12P MolecularWeight: 729.851564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)OC(C(C=O)NC(=O)C(C(CCCCCCCCCCC)O)F)C(C(CO)O)OP(=O)(O)O)O

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)OC(C(C=O)NC(=O)C(C(CCCCCCCCCCC)O)F)C(C(CO)O)OP(=O)(O)O)O

InChI

InChI=1S/C34H65FNO12P/c1-3-5-7-9-11-13-15-17-19-21-26(39)23-30(42)47-32(33(29(41)25-38)48-49(44,45)46)27(24-37)36-34(43)31(35)28(40)22-20-18-16-14-12-10-8-6-4-2/h24,26-29,31-33,38-41H,3-23,25H2,1-2H3,(H,36,43)(H2,44,45,46)