[(E,2S,3R)-2-azanyl-3-oxidanyl-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate

Systemtic Name: [(E,2S,3R)-2-azanyl-3-oxidanyl-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate Openeye Name: [(E,2S,3R)-2-amino-3-hydroxy-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate CAS Name: [(E,2S,3R)-2-amino-3-hydroxy-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate IUPAC Name: [(E,2S,3R)-2-amino-3-hydroxy-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate Traditional Name: [(E,2S,3R)-2-amino-3-hydroxy-5-(4-undecylphenyl)pent-4-enyl] dihydrogen phosphate Formula: C22H38NO5P MolecularWeight: 427.514581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)C=CC(C(COP(=O)(O)O)N)O

Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)/C=C/[C@H]([C@H](COP(=O)(O)O)N)O

InChI

InChI=1S/C22H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-19-12-14-20(15-13-19)16-17-22(24)21(23)18-28-29(25,26)27/h12-17,21-22,24H,2-11,18,23H2,1H3,(H2,25,26,27)/b17-16+/t21-,22+/m0/s1