2-(hexadecylamino)-3-oxidanyl-2-phosphono-propanoic acid

Systemtic Name: 2-(hexadecylamino)-3-oxidanyl-2-phosphono-propanoic acid Openeye Name: 2-(hexadecylamino)-3-hydroxy-2-phosphono-propanoic acid CAS Name: 2-(hexadecylamino)-3-hydroxy-2-phosphonopropanoic acid IUPAC Name: 2-(hexadecylamino)-3-hydroxy-2-phosphonopropanoic acid Traditional Name: 2-(cetylamino)-3-hydroxy-2-phosphono-propionic acid Formula: C19H40NO6P MolecularWeight: 409.497761

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(CO)(C(=O)O)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(CO)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C19H40NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-19(17-21,18(22)23)27(24,25)26/h20-21H,2-17H2,1H3,(H,22,23)(H2,24,25,26)