[2-(hydroxymethyl)-3-oxidanyl-5-[[(3R)-3-oxidanyltetradecanoyl]amino]-6-phosphonooxy-oxan-4-yl] (3R)-3-oxidanyltetradecanoate

Systemtic Name: [2-(hydroxymethyl)-3-oxidanyl-5-[[(3R)-3-oxidanyltetradecanoyl]amino]-6-phosphonooxy-oxan-4-yl] (3R)-3-oxidanyltetradecanoate Openeye Name: [3-hydroxy-2-(hydroxymethyl)-5-[[(3R)-3-hydroxytetradecanoyl]amino]-6-phosphonooxy-tetrahydropyran-4-yl] (3R)-3-hydroxytetradecanoate CAS Name: (3R)-3-hydroxytetradecanoic acid [3-hydroxy-2-(hydroxymethyl)-5-[[(3R)-3-hydroxy-1-oxotetradecyl]amino]-6-phosphonooxy-4-oxanyl] ester IUPAC Name: [3-hydroxy-2-(hydroxymethyl)-5-[[(3R)-3-hydroxytetradecanoyl]amino]-6-phosphonooxyoxan-4-yl] (3R)-3-hydroxytetradecanoate Traditional Name: (3R)-3-hydroxymyristic acid [3-hydroxy-5-[[(3R)-3-hydroxytetradecanoyl]amino]-2-methylol-6-phosphonooxy-tetrahydropyran-4-yl] ester Formula: C34H66NO12P MolecularWeight: 711.861101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC1C(C(C(OC1OP(=O)(O)O)CO)O)OC(=O)CC(CCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCC[C@H](CC(=O)NC1C(C(C(OC1OP(=O)(O)O)CO)O)OC(=O)C[C@@H](CCCCCCCCCCC)O)O

InChI

InChI=1S/C34H66NO12P/c1-3-5-7-9-11-13-15-17-19-21-26(37)23-29(39)35-31-33(32(41)28(25-36)45-34(31)47-48(42,43)44)46-30(40)24-27(38)22-20-18-16-14-12-10-8-6-4-2/h26-28,31-34,36-38,41H,3-25H2,1-2H3,(H,35,39)(H2,42,43,44)/t26-,27-,28?,31?,32?,33?,34?/m1/s1