null CDK 0224162301 null 40 43 0 0 0 0 0 0 0 0999 V2000 0.0338 1.5989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 2.1181 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4031 2.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4217 2.8791 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6595 2.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1806 1.4174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4104 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1336 1.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 1.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 0.7319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0978 0.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3924 0.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6692 0.3661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0661 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6382 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1866 -1.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5835 -0.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1556 0.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0362 0.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4648 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4469 1.6498 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1613 2.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8758 1.6498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8758 0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5903 2.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5903 2.8873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3047 1.6498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0192 2.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7337 1.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4482 2.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1626 1.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1626 0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4482 0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7337 0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8771 0.4123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5916 0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 3.5358 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7394 3.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6019 4.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2165 4.4006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 7 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 2 1 0 0 0 0 21 22 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 29 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 4 37 1 0 0 0 0 37 38 1 1 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 M END > CHEBI:98865 > LSM-10244 > 2 > C32H39N3O5 > 545.670 > 545.28897 > 0 > C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NCC4=CC=C(C=C4)OC)[C@@H](C)CO > InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30-/m1/s1 > BRMWAKMKOMKLLH-DUELTEGESA-N > LSM-10244 $$$$