Mrv1652309102221482D 29 32 0 0 1 0 999 V2000 6.5252 2.4345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7015 2.4817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2489 1.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5591 2.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9386 1.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 1.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9726 1.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5199 0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8909 -0.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7145 -0.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1672 0.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9909 0.3182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4382 -0.9670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6146 -0.9198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -0.1829 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4477 0.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7537 -0.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0204 -0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0188 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7521 1.1687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6753 1.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6361 2.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0972 2.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1364 3.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8697 3.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5576 3.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4085 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1801 1.1504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6962 0.5068 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1 2 2 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 3 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 6 11 1 0 0 0 0 11 12 1 0 0 0 0 9 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 1 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 21 27 2 0 0 0 0 16 27 1 0 0 0 0 27 28 1 0 0 0 0 29 28 1 1 0 0 0 8 29 1 0 0 0 0 15 29 1 0 0 0 0 M END > NP0304600 > NP-MRD > CC(C)=CCC1=C2O[C@@H]3[C@@H](COC4=C3C=C(C(O)=C4)C(C)(C)C=C)C2=CC=C1O > InChI=1S/C25H28O4/c1-6-25(4,5)19-11-17-22(12-21(19)27)28-13-18-15-9-10-20(26)16(8-7-14(2)3)23(15)29-24(17)18/h6-7,9-12,18,24,26-27H,1,8,13H2,2-5H3/t18-,24-/m0/s1 > MVDHBKXZWUGLAH-UUOWRZLLSA-N > C25H28O4 > 392.495 > 392.198759382 > 4 > 57 > 44.10391850419005 > 1 > 2 > 0 > 0 > (1R,10R)-15-(3-methylbut-2-en-1-yl)-4-(2-methylbut-3-en-2-yl)-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-2(7),3,5,11,13,15-hexaene-5,14-diol > 5.777533289000001 > 0 > 4 > 0 > 9.574460750989108 > 8.951071551107411 > -4.592457189406524 > 58.92 > 116.1326 > 4 > 0 > (1R,10R)-15-(3-methylbut-2-en-1-yl)-4-(2-methylbut-3-en-2-yl)-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-2(7),3,5,11,13,15-hexaene-5,14-diol > 0 > NP0304600 > (1r,10r)-15-(3-methylbut-2-en-1-yl)-4-(2-methylbut-3-en-2-yl)-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),3,5,11,13,15-hexaene-5,14-diol $$$$