2-azanylethyl [14-methyl-2-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-3-oxidanyl-pentadecyl] hydrogen phosphate

Systemtic Name: 2-azanylethyl [14-methyl-2-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-3-oxidanyl-pentadecyl] hydrogen phosphate Openeye Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-14-methyl-pentadecyl] hydrogen phosphate CAS Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-1-oxohexadecyl)amino]-14-methylpentadecyl] hydrogen phosphate IUPAC Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methylhexadecanoyl)amino]-14-methylpentadecyl] hydrogen phosphate Traditional Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-14-methyl-pentadecyl] hydrogen phosphate Formula: C35H73N2O7P MolecularWeight: 664.937081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(CC(=O)NC(COP(=O)(O)OCCN)C(CCCCCCCCCCC(C)C)O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCC(CC(=O)NC(COP(=O)(O)OCCN)C(CCCCCCCCCCC(C)C)O)O

InChI

InChI=1S/C35H73N2O7P/c1-30(2)22-18-14-10-6-5-7-12-16-20-24-32(38)28-35(40)37-33(29-44-45(41,42)43-27-26-36)34(39)25-21-17-13-9-8-11-15-19-23-31(3)4/h30-34,38-39H,5-29,36H2,1-4H3,(H,37,40)(H,41,42)