[3-diphenoxyphosphoryloxy-2-(hydroxymethyl)-6-oxidanyl-5-(3-oxidanyltetradecanoylamino)oxan-4-yl] 3-undecylheptadecanoate

Systemtic Name: [3-diphenoxyphosphoryloxy-2-(hydroxymethyl)-6-oxidanyl-5-(3-oxidanyltetradecanoylamino)oxan-4-yl] 3-undecylheptadecanoate Openeye Name: [5-diphenoxyphosphoryloxy-2-hydroxy-6-(hydroxymethyl)-3-(3-hydroxytetradecanoylamino)tetrahydropyran-4-yl] 3-undecylheptadecanoate CAS Name: 3-undecylheptadecanoic acid [5-diphenoxyphosphoryloxy-2-hydroxy-6-(hydroxymethyl)-3-[(3-hydroxy-1-oxotetradecyl)amino]-4-oxanyl] ester IUPAC Name: [5-diphenoxyphosphoryloxy-2-hydroxy-6-(hydroxymethyl)-3-(3-hydroxytetradecanoylamino)oxan-4-yl] 3-undecylheptadecanoate Traditional Name: 3-undecylheptadecanoic acid [5-diphenoxyphosphoryloxy-2-hydroxy-3-(3-hydroxytetradecanoylamino)-6-methylol-tetrahydropyran-4-yl] ester Formula: C60H102NO11P MolecularWeight: 1044.425741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OC1C(C(OC(C1OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)CO)O)NC(=O)CC(CCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OC1C(C(OC(C1OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)CO)O)NC(=O)CC(CCCCCCCCCCC)O

InChI

InChI=1S/C60H102NO11P/c1-4-7-10-13-16-19-20-21-24-26-29-34-41-50(40-33-28-25-22-17-14-11-8-5-2)47-56(65)69-59-57(61-55(64)48-51(63)42-35-30-27-23-18-15-12-9-6-3)60(66)68-54(49-62)58(59)72-73(67,70-52-43-36-31-37-44-52)71-53-45-38-32-39-46-53/h31-32,36-39,43-46,50-51,54,57-60,62-63,66H,4-30,33-35,40-42,47-49H2,1-3H3,(H,61,64)