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

Systemtic Name: (2S)-2-azanyl-3-[oxidanyl-[(2R)-2-oxidanyl-3-tridecanoyloxy-propoxy]phosphoryl]oxy-propanoic acid Openeye Name: (2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-tridecanoyloxy-propoxy]phosphoryl]oxy-propanoic acid CAS Name: (2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-(1-oxotridecoxy)propoxy]phosphoryl]oxypropanoic acid IUPAC Name: (2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-tridecanoyloxypropoxy]phosphoryl]oxypropanoic acid Traditional Name: (2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-tridecanoyloxy-propoxy]phosphoryl]oxy-propionic acid Formula: C19H38NO9P MolecularWeight: 455.480081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)O

Isomeric SMILES

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

InChI

InChI=1S/C19H38NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-18(22)27-13-16(21)14-28-30(25,26)29-15-17(20)19(23)24/h16-17,21H,2-15,20H2,1H3,(H,23,24)(H,25,26)/t16-,17+/m1/s1