Mrv1652309082220462D 40 44 0 0 1 0 999 V2000 -0.5092 -3.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.6772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4061 -1.9944 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6864 -1.2184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.7121 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0618 0.1125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6388 0.5480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7893 0.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5168 0.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1784 -0.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4003 1.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6478 -1.1751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4185 -1.9676 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9249 -2.6189 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6955 -3.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3784 -3.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0297 -3.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7494 -2.5921 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3895 -1.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2812 -1.9614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0934 -2.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3737 -2.8825 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1858 -3.0277 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9055 -2.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7176 -2.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5297 -2.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -3.3182 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6221 -3.4634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9024 -4.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7146 -4.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3706 -4.8700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2782 -3.9489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9917 -4.3631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9942 -4.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4661 -3.8037 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9343 -4.4344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1221 -4.2891 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5903 -4.9199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8418 -3.5132 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3100 -4.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 2 1 1 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 1 0 0 0 6 7 1 1 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 5 12 1 0 0 0 0 12 13 1 0 0 0 0 3 13 1 0 0 0 0 13 14 1 6 0 0 0 14 15 1 1 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 14 18 1 0 0 0 0 18 19 1 1 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 21 1 6 0 0 0 22 23 1 0 0 0 0 23 24 1 6 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 1 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 27 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 23 35 1 0 0 0 0 35 36 1 6 0 0 0 36 37 1 0 0 0 0 37 38 1 1 0 0 0 37 39 1 0 0 0 0 17 39 1 0 0 0 0 22 39 1 0 0 0 0 39 40 1 6 0 0 0 M END > NP0272223 > NP-MRD > CO[C@H]1O[C@H](C[C@@H]1[C@@H]1CC=C2[C@@]1(C)CC[C@@H]1[C@@]3(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]3C[C@@H](O)[C@@]21C)[C@H](O)C(C)(C)O > InChI=1S/C33H54O7/c1-18(34)39-26-13-15-32(7)23-12-14-31(6)20(19-16-21(40-28(19)38-9)27(36)30(4,5)37)10-11-22(31)33(23,8)25(35)17-24(32)29(26,2)3/h11,19-21,23-28,35-37H,10,12-17H2,1-9H3/t19-,20+,21-,23-,24+,25-,26-,27+,28+,31+,32-,33+/m1/s1 > RFBNFKSDHUIMED-INGWFJAISA-N > C33H54O7 > 562.788 > 562.386954079 > 6 > 94 > 65.48621697445168 > 1 > 3 > 0 > 0 > (1R,2S,5R,7R,9R,10R,14S,15S)-14-[(2S,3R,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-9-hydroxy-2,6,6,10,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-11-en-5-yl acetate > 3.712832785999999 > 1 > 5 > 0 > 15.09942127729288 > 13.050987502857868 > -0.3518132924504497 > 105.45 > 153.36530000000002 > 6 > 0 > (1R,2S,5R,7R,9R,10R,14S,15S)-14-[(2S,3R,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-9-hydroxy-2,6,6,10,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-11-en-5-yl acetate > 0 > NP0272223 > (1s,3br,4r,5ar,7r,9as,9br,11as)-1-[(2s,3r,5r)-5-[(1s)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-4-hydroxy-3b,6,6,9a,11a-pentamethyl-1h,2h,4h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl acetate $$$$