Mrv1533004161506482D 37 40 0 0 0 0 999 V2000 -2.0187 -0.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9734 0.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2374 0.4900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5466 0.0389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1894 0.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3168 1.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1462 1.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0149 2.1649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2439 2.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3959 1.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1669 2.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2645 1.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9587 1.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2039 2.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5177 0.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7968 1.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6087 1.8477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8878 2.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6997 2.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 3.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 0.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0012 -0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9114 -0.8386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1302 0.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3852 0.8603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6808 -0.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4537 -0.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6533 -1.1912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -1.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8274 -1.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4007 -1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1736 -2.7711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3732 -2.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7999 -2.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 0.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1953 -0.3657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6642 0.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 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 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 7 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 5 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 7 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 4 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 29 34 1 0 0 0 0 26 35 1 0 0 0 0 15 35 1 0 0 0 0 35 36 2 0 0 0 0 2 37 1 0 0 0 0 M END > NP0327496 > NP-MRD > CC(C)=CCC1CC2(CC=C(C)C)C(=O)C3(CC=C(C)C)CC1(C)C2(O)C(=C(O)C1=CC=CC=C1)C3=O > InChI=1S/C33H42O4/c1-21(2)13-14-25-19-32(18-16-23(5)6)29(36)31(17-15-22(3)4)20-30(25,7)33(32,37)26(28(31)35)27(34)24-11-9-8-10-12-24/h8-13,15-16,25,34,37H,14,17-20H2,1-7H3 > SEJBFXIKYPRBLV-UHFFFAOYSA-N > C33H42O4 > 502.695 > 502.308309832 > 4 > 79 > 58.31126115538399 > 0 > 2 > 0 > 0 > 7-hydroxy-8-[hydroxy(phenyl)methylidene]-6-methyl-1,3,5-tris(3-methylbut-2-en-1-yl)tricyclo[4.3.1.0³,⁷]decane-2,9-dione > 4.96 > 7.351416370333334 > -5.51 > 1 > 4 > -1 > 13.435610922963406 > 6.597352095091371 > -3.6674762694057703 > 74.6 > 152.47169999999997 > 7 > 0 > 1.57e-03 g/l > 7-hydroxy-8-[hydroxy(phenyl)methylidene]-6-methyl-1,3,5-tris(3-methylbut-2-en-1-yl)tricyclo[4.3.1.0³,⁷]decane-2,9-dione > 0 > NP0327496 > 7-hydroxy-8-[hydroxy(phenyl)methylidene]-6-methyl-1,3,5-tris(3-methylbut-2-en-1-yl)tricyclo[4.3.1.0³,⁷]decane-2,9-dione $$$$