O1-(2-methyl-2-adamantyl) O5-[2-methyl-1,5-bis(oxidanyl)-2-adamantyl] 2-ethyl-4-methyl-pentanedioate

Systemtic Name: O1-(2-methyl-2-adamantyl) O5-[2-methyl-1,5-bis(oxidanyl)-2-adamantyl] 2-ethyl-4-methyl-pentanedioate Openeye Name: O1-(1,5-dihydroxy-2-methyl-2-adamantyl) O5-(2-methyl-2-adamantyl) 4-ethyl-2-methyl-pentanedioate CAS Name: 4-ethyl-2-methylpentanedioic acid O1-(1,5-dihydroxy-2-methyl-2-adamantyl) ester O5-(2-methyl-2-adamantyl) ester IUPAC Name: 1-O-(1,5-dihydroxy-2-methyl-2-adamantyl) 5-O-(2-methyl-2-adamantyl) 4-ethyl-2-methylpentanedioate Traditional Name: 4-ethyl-2-methyl-glutaric acid O1-(1,5-dihydroxy-2-methyl-2-adamantyl) ester O5-(2-methyl-2-adamantyl) ester Formula: C30H46O6 MolecularWeight: 502.68264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OC1(C2CC3CC(C2)(CC1(C3)O)O)C)C(=O)OC4(C5CC6CC(C5)CC4C6)C

Isomeric SMILES

CCC(CC(C)C(=O)OC1(C2CC3CC(C2)(CC1(C3)O)O)C)C(=O)OC4(C5CC6CC(C5)CC4C6)C

InChI

InChI=1S/C30H46O6/c1-5-21(26(32)35-27(3)22-8-18-7-19(10-22)11-23(27)9-18)6-17(2)25(31)36-28(4)24-12-20-13-29(33,15-24)16-30(28,34)14-20/h17-24,33-34H,5-16H2,1-4H3