[(3aR,6Z,9S,9aR,10R,11aS)-9-(methoxymethyl)-9a,11a-dimethyl-6-(morpholin-4-ylmethylidene)-5-oxidanyl-1,4,7-tris(oxidanylidene)-2,3,3a,9,10,11-hexahydroindeno[4,5-h]isochromen-10-yl] ethanoate

Systemtic Name: [(3aR,6Z,9S,9aR,10R,11aS)-9-(methoxymethyl)-9a,11a-dimethyl-6-(morpholin-4-ylmethylidene)-5-oxidanyl-1,4,7-tris(oxidanylidene)-2,3,3a,9,10,11-hexahydroindeno[4,5-h]isochromen-10-yl] ethanoate Openeye Name: [(3aR,6Z,9S,9aR,10R,11aS)-5-hydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-(morpholinomethylene)-1,4,7-trioxo-2,3,3a,9,10,11-hexahydroindeno[4,5-h]isochromen-10-yl] acetate CAS Name: acetic acid [(3aR,6Z,9S,9aR,10R,11aS)-5-hydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-(4-morpholinylmethylidene)-1,4,7-trioxo-2,3,3a,9,10,11-hexahydroindeno[4,5-h][2]benzopyran-10-yl] ester IUPAC Name: [(3aR,6Z,9S,9aR,10R,11aS)-5-hydroxy-9-(methoxymethyl)-9a,11a-dimethyl-6-(morpholin-4-ylmethylidene)-1,4,7-trioxo-2,3,3a,9,10,11-hexahydroindeno[4,5-h]isochromen-10-yl] acetate Traditional Name: acetic acid [(3aR,6Z,9S,9aR,10R,11aS)-5-hydroxy-1,4,7-triketo-9-(methoxymethyl)-9a,11a-dimethyl-6-(morpholinomethylene)-2,3,3a,9,10,11-hexahydroinden[4,5-h]isochromen-10-yl] ester Formula: C27H33NO9 MolecularWeight: 515.55222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2(C(CCC2=O)C3=C1C4(C(OC(=O)C(=CN5CCOCC5)C4=C(C3=O)O)COC)C)C

Isomeric SMILES

CC(=O)O[C@@H]1C[C@]2([C@@H](CCC2=O)C3=C1[C@]4([C@H](OC(=O)/C(=C\N5CCOCC5)/C4=C(C3=O)O)COC)C)C

InChI

InChI=1S/C27H33NO9/c1-14(29)36-17-11-26(2)16(5-6-18(26)30)20-22(17)27(3)19(13-34-4)37-25(33)15(21(27)24(32)23(20)31)12-28-7-9-35-10-8-28/h12,16-17,19,32H,5-11,13H2,1-4H3/b15-12-/t16-,17+,19+,26-,27-/m0/s1