(1R,5S,6S,7R,10S,14S,16S)-5,7,9,9-tetramethyl-6,10-bis(oxidanyl)-14-quinolin-7-yl-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-dione

Systemtic Name: (1R,5S,6S,7R,10S,14S,16S)-5,7,9,9-tetramethyl-6,10-bis(oxidanyl)-14-quinolin-7-yl-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-dione Openeye Name: (1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-5,7,9,9-tetramethyl-14-(7-quinolyl)-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-dione CAS Name: (1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-5,7,9,9-tetramethyl-14-(7-quinolinyl)-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-dione IUPAC Name: (1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-5,7,9,9-tetramethyl-14-quinolin-7-yl-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-dione Traditional Name: (1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-5,7,9,9-tetramethyl-14-(7-quinolyl)-13,17-dioxabicyclo[14.1.0]heptadecane-8,12-quinone Formula: C28H37NO6 MolecularWeight: 483.59648

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2C(O2)CC(OC(=O)CC(C(C(=O)C(C1O)C)(C)C)O)C3=CC4=C(C=CC=N4)C=C3

Isomeric SMILES

C[C@H]1CCC[C@@H]2[C@@H](O2)C[C@H](OC(=O)C[C@@H](C(C(=O)[C@@H]([C@H]1O)C)(C)C)O)C3=CC4=C(C=CC=N4)C=C3

InChI

InChI=1S/C28H37NO6/c1-16-7-5-9-21-23(34-21)14-22(19-11-10-18-8-6-12-29-20(18)13-19)35-25(31)15-24(30)28(3,4)27(33)17(2)26(16)32/h6,8,10-13,16-17,21-24,26,30,32H,5,7,9,14-15H2,1-4H3/t16-,17+,21+,22-,23-,24-,26-/m0/s1