656186 -OEChem-03282411472D 42 44 0 1 0 0 0 0 0999 V2000 3.7183 -0.8853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 0.8780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6151 2.0503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8327 -0.6592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3003 0.9890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -1.2422 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -0.2975 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3364 0.2902 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7183 0.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1391 -0.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 1.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 1.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8311 -1.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0907 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 2.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4189 -2.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 1.8173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7842 -0.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5262 -1.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4778 -0.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2198 -1.3853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4734 -1.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 -0.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7832 -1.5019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0806 1.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 2.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9173 -2.4148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -2.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9204 -1.6859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 0.6954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 2.2797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2735 0.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4941 0.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -1.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8164 -1.5702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9671 -0.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1877 -0.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8042 -1.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6798 -1.8009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6355 -0.9252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 26 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 3 11 2 0 0 0 0 4 15 1 0 0 0 0 4 20 1 0 0 0 0 5 15 2 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 14 2 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 25 1 0 0 0 0 16 19 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END > 656186 > 1 > 571 > 6 > 3 > 5 > AAADceB6OAAAAAAAAAAAAAAAAAAAAYIAAAAwAAAAAAAQAGABAAAAHgAQCAAADEyhmAIyCILABgCIAqTSSAKCAAAkAAAIiAFADMkLJj6AtRGGcQhl8AGZucf//PbOgAAAAAAQAAAAAAAAACAAAaAADSgAAA== > butyl 3a,8b-dihydroxy-2-methyl-4-oxo-1H-indeno[1,2-b]pyrrole-3-carboxylate > 3a,8b-dihydroxy-2-methyl-4-oxo-1H-indeno[1,2-b]pyrrole-3-carboxylic acid butyl ester > butyl 3a,8b-dihydroxy-2-methyl-4-oxo-1H-indeno[1,2-b]pyrrole-3-carboxylate > butyl 3a,8b-dihydroxy-2-methyl-4-oxo-1H-indeno[1,2-b]pyrrole-3-carboxylate > butyl 2-methyl-3a,8b-bis(oxidanyl)-4-oxidanylidene-1H-indeno[1,2-b]pyrrole-3-carboxylate > 3a,8b-dihydroxy-4-keto-2-methyl-1H-indeno[1,2-b]pyrrole-3-carboxylic acid butyl ester > InChI=1S/C17H19NO5/c1-3-4-9-23-15(20)13-10(2)18-17(22)12-8-6-5-7-11(12)14(19)16(13,17)21/h5-8,18,21-22H,3-4,9H2,1-2H3 > MIQWYWWCDGGBGC-UHFFFAOYSA-N > 1.8 > 317.12632271 > C17H19NO5 > 317.34 > CCCCOC(=O)C1=C(NC2(C1(C(=O)C3=CC=CC=C32)O)O)C > CCCCOC(=O)C1=C(NC2(C1(C(=O)C3=CC=CC=C32)O)O)C > 95.9 > 317.12632271 > 0 > 23 > 0 > 2 > 0 > 0 > 0 > 1 > 3 > 1 5 255 > 7 1 3 12 16 8 14 18 8 16 19 8 18 19 8 8 2 3 9 12 8 9 14 8 $$$$