Mrv1652309022202362D 42 46 0 0 1 0 999 V2000 1.4289 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -9.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -9.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7145 -10.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -11.1375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0000 -11.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -11.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -11.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -12.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -12.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -12.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -13.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -14.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -14.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -15.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -16.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -16.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -15.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -14.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -14.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -13.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -12.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -11.5500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4289 -12.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -11.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -10.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8579 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -6.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -6.6000 0.0000 C 0 0 0 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 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 13 12 1 1 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 6 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 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 24 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 22 30 1 0 0 0 0 30 31 1 0 0 0 0 21 32 2 0 0 0 0 16 32 1 0 0 0 0 15 33 1 0 0 0 0 33 34 1 1 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 13 36 1 0 0 0 0 36 37 1 6 0 0 0 12 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 10 40 1 0 0 0 0 40 41 1 0 0 0 0 9 42 2 0 0 0 0 4 42 1 0 0 0 0 M END > NP0145412 > NP-MRD > C[C@H]1O[C@H](C)[C@H](O[C@@H]1C1=CC=C(O)C(=C1)C1=CC(CC=C)=CC=C1O)C1=CC=C(O)C(=C1)C1=CC(CC=C)=CC=C1O > InChI=1S/C36H36O6/c1-5-7-23-9-13-31(37)27(17-23)29-19-25(11-15-33(29)39)35-21(3)41-22(4)36(42-35)26-12-16-34(40)30(20-26)28-18-24(8-6-2)10-14-32(28)38/h5-6,9-22,35-40H,1-2,7-8H2,3-4H3/t21-,22-,35+,36+/m1/s1 > GGSCBAFZUOZBIR-XKKCTNAZSA-N > C36H36O6 > 564.678 > 564.251188879 > 6 > 78 > 62.39817741668012 > 0 > 4 > 0 > 0 > 5-[(2R,3R,5R,6R)-6-[2',6-dihydroxy-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-yl]-3,5-dimethyl-1,4-dioxan-2-yl]-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-2,2'-diol > 6.38 > 8.585010310666666 > -5.41 > 1 > 5 > 0 > 8.869537407498813 > 8.373544304384696 > -3.9326761870869906 > 99.38000000000001 > 166.2608 > 8 > 0 > 2.20e-03 g/l > 5-[(2R,3R,5R,6R)-6-[2',6-dihydroxy-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-yl]-3,5-dimethyl-1,4-dioxan-2-yl]-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-2,2'-diol > 0 > NP0145412 > 5-[(2r,3r,5r,6r)-6-[2',6-dihydroxy-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-yl]-3,5-dimethyl-1,4-dioxan-2-yl]-5'-(prop-2-en-1-yl)-[1,1'-biphenyl]-2,2'-diol $$$$