Mrv1652309062212402D 66 73 0 0 0 0 999 V2000 6.9542 -2.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7663 -2.1103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0466 -1.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5148 -0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7951 0.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2632 0.7029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4511 0.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3587 -0.3634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8269 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5466 -0.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1072 1.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5754 1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7633 1.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 0.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.3835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0148 0.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 -0.6539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9224 -0.7991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6421 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1739 -2.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8936 -2.9816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -2.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0784 -1.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6102 -1.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3299 -2.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5178 -2.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3905 -0.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0307 -0.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -0.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6255 -0.9644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7538 -0.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 0.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4736 -1.0627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3367 0.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0195 1.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6708 0.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6113 1.4304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9193 1.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6072 0.2174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 -0.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9511 -0.2681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8587 -1.1892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3905 -1.8199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1102 -2.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2981 -2.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0178 -3.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2057 -3.6622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6739 -3.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5496 -4.1477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2693 -4.9236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4572 -5.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9254 -4.4381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1133 -4.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5815 -3.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 -5.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0209 -5.5045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3648 -5.9899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0845 -6.7659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6163 -7.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1769 -5.8447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7087 -6.4754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3617 -4.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8936 -4.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -3.2265 0.0000 O 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 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 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 10 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 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 23 28 1 0 0 0 0 19 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 31 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 15 38 1 0 0 0 0 29 38 1 0 0 0 0 38 39 1 0 0 0 0 12 40 1 0 0 0 0 7 40 1 0 0 0 0 5 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 3 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 48 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 59 62 1 0 0 0 0 53 62 1 0 0 0 0 62 63 1 0 0 0 0 51 64 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 46 66 1 0 0 0 0 M END > NP0230267 > NP-MRD > COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(OC(=O)C3=CC=CC=C3)C3(C)C(O)(CCC43O)C(C)O)C2)OC(C)C1OC1CC(OC)C(OC2OC(C)C(O)C(OC)C2O)C(C)O1 > InChI=1S/C49H76O17/c1-25-38(51)42(59-9)39(52)44(62-25)66-41-27(3)61-37(23-33(41)58-8)65-40-26(2)60-36(22-32(40)57-7)63-31-16-17-45(5)30(21-31)15-18-48(55)34(45)24-35(64-43(53)29-13-11-10-12-14-29)46(6)47(54,28(4)50)19-20-49(46,48)56/h10-14,25-28,30-42,44,50-52,54-56H,15-24H2,1-9H3 > OVOSPCKCJQHZPN-UHFFFAOYSA-N > C49H76O17 > 937.13 > 936.508250987 > 16 > 142 > 101.8649743642768 > 0 > 6 > 0 > 0 > 5-{[5-({5-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-10,11,14-trihydroxy-14-(1-hydroxyethyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-16-yl benzoate > 3.592627599000002 > 1 > 8 > 0 > 12.785244412139601 > 12.181063344980142 > -3.1355438885466684 > 230.74999999999994 > 233.2356 > 13 > 0 > 5-{[5-({5-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-10,11,14-trihydroxy-14-(1-hydroxyethyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-16-yl benzoate > 0 > NP0230267 > 7-{[5-({5-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-1,3a,3b-trihydroxy-1-(1-hydroxyethyl)-9a,11a-dimethyl-dodecahydrocyclopenta[a]phenanthren-11-yl benzoate $$$$