[(2R,3R,4S,5R,6R)-5-azido-2-diphenoxyphosphoryloxy-6-methyl-4-phenylmethoxy-oxan-3-yl] 4-oxidanylidenepentanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-5-azido-2-diphenoxyphosphoryloxy-6-methyl-4-phenylmethoxy-oxan-3-yl] 4-oxidanylidenepentanoate Openeye Name: [(2R,3R,4S,5R,6R)-5-azido-4-benzyloxy-2-diphenoxyphosphoryloxy-6-methyl-tetrahydropyran-3-yl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [(2R,3R,4S,5R,6R)-5-azido-2-diphenoxyphosphoryloxy-6-methyl-4-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5R,6R)-5-azido-2-diphenoxyphosphoryloxy-6-methyl-4-phenylmethoxyoxan-3-yl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [(2R,3R,4S,5R,6R)-5-azido-4-benzoxy-2-diphenoxyphosphoryloxy-6-methyl-tetrahydropyran-3-yl] ester Formula: C30H32N3O9P MolecularWeight: 609.563541

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC(=O)CCC(=O)C)OCC4=CC=CC=C4)N=[N+]=[N-]

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC(=O)CCC(=O)C)OCC4=CC=CC=C4)N=[N+]=[N-]

InChI

InChI=1S/C30H32N3O9P/c1-21(34)18-19-26(35)39-29-28(37-20-23-12-6-3-7-13-23)27(32-33-31)22(2)38-30(29)42-43(36,40-24-14-8-4-9-15-24)41-25-16-10-5-11-17-25/h3-17,22,27-30H,18-20H2,1-2H3/t22-,27-,28+,29-,30-/m1/s1