[2-(6-aminopurin-9-yl)ethoxymethyl-(dodecanoyloxymethoxy)phosphoryl]oxymethyl dodecanoate

Systemtic Name: [2-(6-aminopurin-9-yl)ethoxymethyl-(dodecanoyloxymethoxy)phosphoryl]oxymethyl dodecanoate Openeye Name: [2-(6-aminopurin-9-yl)ethoxymethyl-(dodecanoyloxymethoxy)phosphoryl]oxymethyl dodecanoate CAS Name: dodecanoic acid [2-(6-aminopurin-9-yl)ethoxymethyl-(1-oxododecoxymethoxy)phosphoryl]oxymethyl ester IUPAC Name: [2-(6-aminopurin-9-yl)ethoxymethyl-(dodecanoyloxymethoxy)phosphoryl]oxymethyl dodecanoate Traditional Name: lauric acid [2-adenin-9-ylethoxymethyl(lauroyloxymethoxy)phosphoryl]oxymethyl ester Formula: C34H60N5O8P MolecularWeight: 697.842661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCOP(=O)(COCCN1C=NC2=C1N=CN=C2N)OCOC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCOP(=O)(COCCN1C=NC2=C1N=CN=C2N)OCOC(=O)CCCCCCCCCCC

InChI

InChI=1S/C34H60N5O8P/c1-3-5-7-9-11-13-15-17-19-21-30(40)44-27-46-48(42,29-43-24-23-39-26-38-32-33(35)36-25-37-34(32)39)47-28-45-31(41)22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24,27-29H2,1-2H3,(H2,35,36,37)