[(1S,2R,5S,6R)-5-methoxy-3-naphthalen-1-yl-6-phenylmethoxy-2-sulfooxy-cyclohex-3-en-1-yl] hydrogen sulfate

Systemtic Name: [(1S,2R,5S,6R)-5-methoxy-3-naphthalen-1-yl-6-phenylmethoxy-2-sulfooxy-cyclohex-3-en-1-yl] hydrogen sulfate Openeye Name: [(1S,2R,5S,6R)-6-benzyloxy-5-methoxy-3-(1-naphthyl)-2-sulfooxy-cyclohex-3-en-1-yl] hydrogen sulfate CAS Name: sulfuric acid [(1S,2R,5S,6R)-5-methoxy-3-(1-naphthalenyl)-6-phenylmethoxy-2-sulfooxy-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,2R,5S,6R)-5-methoxy-3-naphthalen-1-yl-6-phenylmethoxy-2-sulfooxycyclohex-3-en-1-yl] hydrogen sulfate Traditional Name: sulfuric acid [(1S,2R,5S,6R)-6-benzoxy-5-methoxy-3-(1-naphthyl)-2-sulfoxy-cyclohex-3-en-1-yl] ester Formula: C24H24O10S2 MolecularWeight: 536.57136

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=C(C(C(C1OCC2=CC=CC=C2)OS(=O)(=O)O)OS(=O)(=O)O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CO[C@H]1C=C([C@H]([C@H]([C@@H]1OCC2=CC=CC=C2)OS(=O)(=O)O)OS(=O)(=O)O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H24O10S2/c1-31-21-14-20(19-13-7-11-17-10-5-6-12-18(17)19)22(33-35(25,26)27)24(34-36(28,29)30)23(21)32-15-16-8-3-2-4-9-16/h2-14,21-24H,15H2,1H3,(H,25,26,27)(H,28,29,30)/t21-,22+,23+,24+/m0/s1