Mrv1652306242119503D 41 43 0 0 0 0 999 V2000 -3.6697 -0.5928 -0.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7108 -0.5883 0.3963 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9526 0.6057 1.3581 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2855 1.7537 0.7241 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6568 0.6108 2.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 0.0901 1.3433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 -0.2682 1.2811 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5096 0.8341 0.6857 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5781 0.1229 -0.1255 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8294 0.9310 -1.3719 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 0.0790 0.6265 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0735 -1.2790 -0.3991 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7738 -1.4297 0.2959 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4755 -1.3984 -0.5001 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2217 -1.2256 -1.8346 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2911 -0.2347 0.0124 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3304 0.9066 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2242 0.3627 -0.8635 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4633 -1.3599 -0.5027 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2003 -0.9280 -1.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7069 -1.4779 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 0.3257 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 2.5828 1.1342 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5262 0.9927 3.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1678 -0.6011 2.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0767 1.3930 1.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9812 1.5905 0.1141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8634 1.3787 -1.6822 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2589 0.2826 -2.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5728 1.7343 -1.0975 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 1.0973 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7837 -0.4315 1.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6179 -0.4753 0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1525 -1.6101 -1.4291 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7987 -1.9703 0.1653 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7334 -2.3839 0.9129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0886 -2.3388 -0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5802 -0.7103 -2.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4698 0.8557 -1.6221 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2988 1.9011 -0.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2277 0.8727 -1.6144 H 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 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 6 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 6 0 0 0 16 2 1 0 0 0 0 16 6 1 0 0 0 0 13 7 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 1 0 0 0 3 22 1 1 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 7 25 1 1 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 1 0 0 0 14 37 1 6 0 0 0 15 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 M END > NP0013843 > NP-MRD > [H]O[C@]1([H])C([H])=C2[C@]3([H])C([H])([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@]3([H])[C@]([H])(O[H])[C@@]2(C([H])([H])[H])[C@]1([H])C([H])([H])[H] > InChI=1S/C15H24O2/c1-8-12(16)5-11-9-6-14(2,3)7-10(9)13(17)15(8,11)4/h5,8-10,12-13,16-17H,6-7H2,1-4H3/t8-,9-,10+,12-,13+,15+/m1/s1 > QRVSAVYBBHXMDC-HIEKWVOZSA-N > C15H24O2 > 236.355 > 236.177630013 > 2 > 41 > 27.558434937044332 > 1 > 2 > 0 > 1 > (1R,4R,5S,6S,7S,8S)-5,6,10,10-tetramethyltricyclo[6.3.0.0^{2,6}]undec-2-ene-4,7-diol > 1.94 > 1.7954435123333332 > -2.49 > 0 > 3 > 0 > 14.785478943824618 > 14.163447930486694 > -2.9980106556977493 > 40.46 > 68.5714 > 0 > 1 > 7.58e-01 g/l > (1R,4R,5S,6S,7S,8S)-5,6,10,10-tetramethyltricyclo[6.3.0.0^{2,6}]undec-2-ene-4,7-diol > 0 > NP0013843 > Antrodin C $$$$