Mrv1652306212101133D 60 65 0 0 0 0 999 V2000 -3.1862 1.1347 2.9709 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6546 1.0410 3.1738 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4001 0.1625 4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1529 2.4571 3.4925 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7988 3.2623 4.1615 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2003 2.8584 3.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 2.0457 2.3223 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5982 0.6557 1.8244 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3673 -0.2956 2.7659 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9828 0.4113 0.3278 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5495 1.3787 -0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7251 1.3242 -1.9431 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6823 0.4044 -2.5889 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7358 1.0159 -2.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0277 0.0031 -4.0710 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6474 0.9833 -5.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0708 -5.8915 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4174 2.1424 -6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7946 2.7242 -6.5685 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4343 2.0201 -5.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4061 -1.4159 -4.2176 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5765 -2.0231 -2.8520 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8585 -1.7806 -2.2788 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7599 -0.9248 -1.8515 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5355 -0.9512 -0.3261 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2743 -2.1687 0.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9617 -1.1498 -0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7511 -1.6200 -0.8398 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4383 -0.8523 1.3957 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9681 0.5365 1.8603 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6474 0.1477 2.8671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6783 1.6191 3.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4321 1.7262 2.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6433 -0.8871 4.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3677 0.2224 4.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0184 0.4910 5.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5423 3.8302 3.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9997 2.3804 2.1329 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3534 -0.5503 2.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5639 0.1499 3.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8304 -1.2236 2.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8536 2.3342 -0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7481 0.9895 -2.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6291 2.3368 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7891 1.9777 -3.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4904 0.3507 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.2094 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1194 -0.1283 -4.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4323 0.4369 -5.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0529 2.5961 -7.4886 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4279 2.3700 -5.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9236 -1.9993 -4.9859 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -1.3822 -4.4682 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 -2.9190 -2.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9537 -2.4133 1.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0754 -3.0827 -0.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3589 -2.0126 0.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -1.6564 2.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5314 -0.8955 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3285 1.2335 1.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 13 14 1 6 0 0 0 25 10 1 0 0 0 0 11 12 1 0 0 0 0 30 2 1 0 0 0 0 8 7 1 0 0 0 0 7 6 2 0 0 0 0 15 21 1 0 0 0 0 25 24 1 0 0 0 0 13 12 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 25 27 1 0 0 0 0 24 23 1 1 0 0 0 10 8 1 0 0 0 0 2 1 1 6 0 0 0 30 29 1 0 0 0 0 2 4 1 0 0 0 0 6 4 1 0 0 0 0 29 27 1 0 0 0 0 4 5 2 0 0 0 0 24 22 1 0 0 0 0 2 3 1 0 0 0 0 25 26 1 1 0 0 0 22 21 1 0 0 0 0 27 28 2 0 0 0 0 22 23 1 0 0 0 0 16 20 2 0 0 0 0 15 13 1 0 0 0 0 8 9 1 1 0 0 0 30 8 1 0 0 0 0 11 10 2 0 0 0 0 20 19 1 0 0 0 0 19 18 1 0 0 0 0 18 17 2 0 0 0 0 17 16 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 22 54 1 1 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 30 60 1 6 0 0 0 7 38 1 0 0 0 0 6 37 1 0 0 0 0 15 48 1 1 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 20 51 1 0 0 0 0 18 50 1 0 0 0 0 17 49 1 0 0 0 0 M END > NP0041260 > NP-MRD > [H]C1=C([H])C(=C([H])O1)[C@]1([H])C([H])([H])[C@@]2([H])O[C@@]22[C@@]1(C([H])([H])[H])C([H])([H])C([H])=C1[C@]3(C([H])=C([H])C(=O)C(C([H])([H])[H])(C([H])([H])[H])[C@]3([H])C([H])([H])C(=O)[C@@]21C([H])([H])[H])C([H])([H])[H] > InChI=1S/C26H30O4/c1-22(2)18-13-20(28)25(5)17(23(18,3)9-7-19(22)27)6-10-24(4)16(15-8-11-29-14-15)12-21-26(24,25)30-21/h6-9,11,14,16,18,21H,10,12-13H2,1-5H3/t16-,18-,21+,23+,24-,25-,26+/m0/s1 > PZLVBUOJKJVNND-ZOKFZIQPSA-N > C26H30O4 > 406.522 > 406.214409446 > 3 > 60 > 44.59638686109725 > 1 > 0 > 0 > 1 > (1R,2R,4R,6R,7S,11S,16R)-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-3-oxapentacyclo[8.8.0.0^{2,4}.0^{2,7}.0^{11,16}]octadeca-9,12-diene-14,18-dione > 5.20 > 4.610553296666665 > -4.60 > 0 > 6 > 0 > 18.206742803726588 > -2.786079227913506 > 59.81 > 114.65719999999996 > 1 > 1 > 1.01e-02 g/l > (1R,2R,4R,6R,7S,11S,16R)-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-3-oxapentacyclo[8.8.0.0^{2,4}.0^{2,7}.0^{11,16}]octadeca-9,12-diene-14,18-dione > 0 > NP0041260 > toonayunnanin A $$$$