Mrv1652304282218042D 30 35 0 0 1 0 999 V2000 4.8862 1.0212 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6530 0.7168 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3000 1.2287 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0668 0.9244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1866 0.1082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5397 -0.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7729 -0.0994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9535 -0.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1802 2.0450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4133 2.3493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7664 1.8374 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9530 1.9757 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5702 1.2449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1469 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7459 1.2110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3044 1.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6873 2.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5116 2.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4801 1.8741 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0973 1.1433 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5388 0.4464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3631 0.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1559 -0.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3316 -0.3183 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1098 0.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 1.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0512 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0386 2.5710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8271 2.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0061 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 1 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 2 7 1 0 0 0 0 5 8 1 6 0 0 0 3 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 6 0 0 0 1 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 1 0 0 0 1 14 1 1 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 12 18 1 1 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 1 0 0 0 21 22 1 0 0 0 0 15 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 20 26 1 0 0 0 0 24 27 1 6 0 0 0 19 28 1 6 0 0 0 9 29 1 1 0 0 0 2 30 1 1 0 0 0 M END > NP0070639 > NP-MRD > C[C@@H]1CC[C@H]2[C@H](C)C3=C(CN2C1)[C@@H]1C[C@H]2[C@@H](C[C@@H](O)[C@H]4C[C@H](O)CC[C@]24C)[C@@H]1CC3 > InChI=1S/C27H43NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-17,19-21,23-26,29-30H,4-14H2,1-3H3/t15-,16-,17-,19-,20-,21+,23+,24-,25+,26-,27-/m1/s1 > OEJGVNMSFPGDPP-RHNKUPFDSA-N > C27H43NO2 > 413.646 > 413.329379629 > 3 > 73 > 49.48291795890985 > 1 > 2 > 0 > 0 > (1R,6R,9S,10R,14S,15S,17R,18S,20R,23R,24S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacos-2(11)-ene-17,20-diol > 3.33 > 3.545078216666666 > -4.52 > 0 > 6 > 1 > 15.420142999618392 > 14.751601444894536 > 10.386788993806235 > 43.7 > 122.439 > 0 > 1 > 1.24e-02 g/l > (1R,6R,9S,10R,14S,15S,17R,18S,20R,23R,24S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.0^{2,11}.0^{4,9}.0^{15,24}.0^{18,23}]pentacos-2(11)-ene-17,20-diol > 0 > NP0070639 > Ziebeimine $$$$