Mrv1652304282213512D 29 35 0 0 1 0 999 V2000 5.6964 3.2245 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5962 2.0555 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2490 1.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4395 2.3972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3883 2.9135 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4090 2.3164 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3708 3.2679 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7680 3.1302 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7873 2.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8668 1.9262 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0238 2.6419 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3604 2.2247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7188 1.9184 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1561 1.1699 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0332 1.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 1.9423 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7458 0.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9208 0.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5104 -0.2640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5061 1.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5589 2.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8148 3.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 3.1916 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4028 4.0133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0427 3.6770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0669 4.5016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3648 4.9349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3131 3.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4296 1.2474 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 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 1 0 0 0 7 8 1 0 0 0 0 8 9 1 1 0 0 0 10 9 1 1 0 0 0 2 10 1 0 0 0 0 6 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 6 0 0 0 13 12 1 6 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 15 1 6 0 0 0 6 16 1 0 0 0 0 11 16 1 0 0 0 0 14 17 1 6 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 11 23 1 0 0 0 0 23 24 1 1 0 0 0 7 25 1 1 0 0 0 1 25 1 6 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 5 28 1 1 0 0 0 1 28 1 0 0 0 0 2 29 1 1 0 0 0 M END > NP0067294 > NP-MRD > CCN1[C@@H]2[C@@H]3C[C@H]4[C@]2([C@@H]2C[C@H](OC(C)=O)[C@@H]5C[C@]32[C@H](O)C5=C)[C@@H]2CC[C@@]4(C)[C@H]1O2 > InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(28-12(3)26)13-10-23(14,17)20(27)11(13)2/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14+,15+,16-,17-,18+,19-,20-,21-,22-,23+,24+/m1/s1 > YRUSHCSMDUSKBH-XAPSJECXSA-N > C24H33NO4 > 399.531 > 399.240958547 > 4 > 62 > 44.28781672207549 > 1 > 1 > 0 > 1 > (1R,2R,4S,5R,8S,10R,12R,13S,14R,16S,17R,19R)-11-ethyl-19-hydroxy-5-methyl-18-methylidene-9-oxa-11-azaheptacyclo[15.2.1.0^{1,14}.0^{2,12}.0^{4,13}.0^{5,10}.0^{8,13}]icosan-16-yl acetate > 2.01 > 1.7694913279999998 > -3.04 > 0 > 7 > 0 > 14.127791951010398 > 6.354214278639595 > 59.0 > 106.3599 > 3 > 1 > 3.67e-01 g/l > (1R,2R,4S,5R,8S,10R,12R,13S,14R,16S,17R,19R)-11-ethyl-19-hydroxy-5-methyl-18-methylidene-9-oxa-11-azaheptacyclo[15.2.1.0^{1,14}.0^{2,12}.0^{4,13}.0^{5,10}.0^{8,13}]icosan-16-yl acetate > 0 > NP0067294 > Anhydroepoxynapelline 12-acetate $$$$