[(2R,3S,4R,5R)-5-(3-aminocarbonylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl 5-naphthalen-1-yloxypentyl phosphate

Systemtic Name: [(2R,3S,4R,5R)-5-(3-aminocarbonylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl 5-naphthalen-1-yloxypentyl phosphate Openeye Name: [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 5-(1-naphthyloxy)pentyl phosphate CAS Name: [(2R,3S,4R,5R)-5-(3-carbamoyl-1-pyridin-1-iumyl)-3,4-dihydroxy-2-oxolanyl]methyl 5-(1-naphthalenyloxy)pentyl phosphate IUPAC Name: [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl 5-naphthalen-1-yloxypentyl phosphate Traditional Name: [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 5-(1-naphthoxy)pentyl phosphate Formula: C26H31N2O9P MolecularWeight: 546.506101

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCCCCCOP(=O)([O-])OCC3C(C(C(O3)[N+]4=CC=CC(=C4)C(=O)N)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCCCCCOP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)[N+]4=CC=CC(=C4)C(=O)N)O)O

InChI

InChI=1S/C26H31N2O9P/c27-25(31)19-10-7-13-28(16-19)26-24(30)23(29)22(37-26)17-36-38(32,33)35-15-5-1-4-14-34-21-12-6-9-18-8-2-3-11-20(18)21/h2-3,6-13,16,22-24,26,29-30H,1,4-5,14-15,17H2,(H2-,27,31,32,33)/t22-,23-,24-,26-/m1/s1