O1-[[3-[(3-methoxy-5-oxidanyl-1-adamantyl)oxycarbonyl]-5-oxidanyl-1-adamantyl]carbonyl] O3-methyl 5-oxidanyladamantane-1,3-dicarboxylate

Systemtic Name: O1-[[3-[(3-methoxy-5-oxidanyl-1-adamantyl)oxycarbonyl]-5-oxidanyl-1-adamantyl]carbonyl] O3-methyl 5-oxidanyladamantane-1,3-dicarboxylate Openeye Name: O1-[3-hydroxy-5-[(3-hydroxy-5-methoxy-1-adamantyl)oxycarbonyl]adamantane-1-carbonyl] O3-methyl 5-hydroxyadamantane-1,3-dicarboxylate CAS Name: 5-hydroxyadamantane-1,3-dicarboxylic acid O1-[[3-hydroxy-5-[(3-hydroxy-5-methoxy-1-adamantyl)oxy-oxomethyl]-1-adamantyl]-oxomethyl] ester O3-methyl ester IUPAC Name: 1-O-[3-hydroxy-5-[(3-hydroxy-5-methoxy-1-adamantyl)oxycarbonyl]adamantane-1-carbonyl] 3-O-methyl 5-hydroxyadamantane-1,3-dicarboxylate Traditional Name: 5-hydroxyadamantane-1,3-dicarboxylic acid O1-[3-hydroxy-5-[(3-hydroxy-5-methoxy-1-adamantyl)oxycarbonyl]adamantane-1-carbonyl] ester O3-methyl ester Formula: C36H48O11 MolecularWeight: 656.75972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC3CC(C1)(CC(C3)(C2)O)C(=O)OC(=O)C45CC6CC(C4)(CC(C6)(C5)O)C(=O)OC78CC9CC(C7)(CC(C9)(C8)OC)O

Isomeric SMILES

COC(=O)C12CC3CC(C1)(CC(C3)(C2)O)C(=O)OC(=O)C45CC6CC(C4)(CC(C6)(C5)O)C(=O)OC78CC9CC(C7)(CC(C9)(C8)OC)O

InChI

InChI=1S/C36H48O11/c1-44-24(37)28-3-21-4-29(12-28,15-32(41,7-21)14-28)25(38)46-26(39)30-5-22-6-31(13-30,17-33(42,8-22)16-30)27(40)47-36-11-23-9-34(43,19-36)18-35(10-23,20-36)45-2/h21-23,41-43H,3-20H2,1-2H3