1-adamantyl 2-[1-[(4Z)-7a-methyl-4-[(2E)-2-[2-methylidene-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]ethanoate

Systemtic Name: 1-adamantyl 2-[1-[(4Z)-7a-methyl-4-[(2E)-2-[2-methylidene-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]ethanoate Openeye Name: 1-adamantyl 2-[1-[(4Z)-4-[(2E)-2-(3,5-dihydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]acetate CAS Name: 2-[1-[(4Z)-4-[(2E)-2-(3,5-dihydroxy-2-methylenecyclohexylidene)ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]acetic acid 1-adamantyl ester IUPAC Name: 1-adamantyl 2-[1-[(4Z)-4-[(2E)-2-(3,5-dihydroxy-2-methylidenecyclohexylidene)ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]acetate Traditional Name: 2-[1-[(4Z)-4-[(2E)-2-(3,5-dihydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]ethoxy]acetic acid 1-adamantyl ester Formula: C33H46O5 MolecularWeight: 522.71534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C)OCC(=O)OC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C1=CCC\2C1(CCC/C2=C/C=C/3\CC(CC(C3=C)O)O)C)OCC(=O)OC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H46O5/c1-20-26(14-27(34)15-30(20)35)7-6-25-5-4-10-32(3)28(8-9-29(25)32)21(2)37-19-31(36)38-33-16-22-11-23(17-33)13-24(12-22)18-33/h6-8,21-24,27,29-30,34-35H,1,4-5,9-19H2,2-3H3/b25-6-,26-7+