Mrv1533004261503252D 36 40 0 0 0 0 999 V2000 5.2520 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8395 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 1.8414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 -1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1105 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9355 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1105 1.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9355 1.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9355 3.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 3.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 3.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5855 4.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4105 4.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 5.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4105 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5855 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 6.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 5.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1105 3.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 2.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 1.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -0.3020 0.0000 C 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 7 17 1 0 0 0 0 11 17 1 0 0 0 0 15 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 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 25 31 1 0 0 0 0 22 32 1 0 0 0 0 32 33 2 0 0 0 0 18 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 8 36 2 0 0 0 0 3 36 1 0 0 0 0 M END > NP0276326 > NP-MRD > COC1=CC(O)=C2C(CCC3=CC(O)=C(C=C23)C2=C(O)C=C(CCC3=CC=CC(O)=C3)C=C2OC)=C1 > InChI=1S/C30H28O6/c1-35-22-13-20-9-8-19-14-25(32)24(16-23(19)29(20)27(34)15-22)30-26(33)11-18(12-28(30)36-2)7-6-17-4-3-5-21(31)10-17/h3-5,10-16,31-34H,6-9H2,1-2H3 > OGMXCOLFDLJPDW-UHFFFAOYSA-N > C30H28O6 > 484.548 > 484.188588622 > 6 > 64 > 53.83251626566554 > 1 > 4 > 0 > 0 > 3-{2-hydroxy-4-[2-(3-hydroxyphenyl)ethyl]-6-methoxyphenyl}-7-methoxy-9,10-dihydrophenanthrene-2,5-diol > 4.85 > 6.83757229 > -5.57 > 0 > 5 > 0 > 9.287483310392084 > 8.742816179479496 > -4.545056897818108 > 99.38000000000001 > 139.79879999999997 > 5 > 0 > 1.31e-03 g/l > 3-{2-hydroxy-4-[2-(3-hydroxyphenyl)ethyl]-6-methoxyphenyl}-7-methoxy-9,10-dihydrophenanthrene-2,5-diol > 0 > NP0276326 > 3-{2-hydroxy-4-[2-(3-hydroxyphenyl)ethyl]-6-methoxyphenyl}-7-methoxy-9,10-dihydrophenanthrene-2,5-diol $$$$