(2S)-2-azanyl-3-[[(2R)-3-dodecanoyloxy-2-tridecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[[(2R)-3-dodecanoyloxy-2-tridecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid Openeye Name: (2S)-2-amino-3-[[(2R)-3-dodecanoyloxy-2-tridecanoyloxy-propoxy]-hydroxy-phosphoryl]oxy-propanoic acid CAS Name: (2S)-2-amino-3-[hydroxy-[(2R)-3-(1-oxododecoxy)-2-(1-oxotridecoxy)propoxy]phosphoryl]oxypropanoic acid IUPAC Name: (2S)-2-amino-3-[[(2R)-3-dodecanoyloxy-2-tridecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid Traditional Name: (2S)-2-amino-3-[hydroxy-[(2R)-3-lauroyloxy-2-tridecanoyloxy-propoxy]phosphoryl]oxy-propionic acid Formula: C31H60NO10P MolecularWeight: 637.782561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COP(=O)(O)OCC(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)(O)OC[C@@H](C(=O)O)N

InChI

InChI=1S/C31H60NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-30(34)42-27(25-40-43(37,38)41-26-28(32)31(35)36)24-39-29(33)22-20-18-16-14-12-10-8-6-4-2/h27-28H,3-26,32H2,1-2H3,(H,35,36)(H,37,38)/t27-,28+/m1/s1