2-azanylethyl [16-methyl-2-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-3-oxidanyl-heptadecyl] hydrogen phosphate

Systemtic Name: 2-azanylethyl [16-methyl-2-[(15-methyl-3-oxidanyl-hexadecanoyl)amino]-3-oxidanyl-heptadecyl] hydrogen phosphate Openeye Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-16-methyl-heptadecyl] hydrogen phosphate CAS Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-1-oxohexadecyl)amino]-16-methylheptadecyl] hydrogen phosphate IUPAC Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methylhexadecanoyl)amino]-16-methylheptadecyl] hydrogen phosphate Traditional Name: 2-aminoethyl [3-hydroxy-2-[(3-hydroxy-15-methyl-hexadecanoyl)amino]-16-methyl-heptadecyl] hydrogen phosphate Formula: C37H77N2O7P MolecularWeight: 692.990241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H77N2O7P/c1-32(2)24-20-16-12-8-5-6-11-15-19-23-27-36(41)35(31-46-47(43,44)45-29-28-38)39-37(42)30-34(40)26-22-18-14-10-7-9-13-17-21-25-33(3)4/h32-36,40-41H,5-31,38H2,1-4H3,(H,39,42)(H,43,44)