Mrv1533004261505352D 61 69 0 0 0 0 999 V2000 4.3030 -3.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -3.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4082 -2.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2223 -2.2464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7452 -2.8845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1155 -2.1473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9311 -2.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -1.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2507 -2.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0743 -2.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4446 -1.6877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2682 -1.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7215 -2.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5451 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9984 -2.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8221 -2.9224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6282 -3.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8046 -3.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4343 -4.4928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8876 -5.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7112 -5.1341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1645 -5.8234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7942 -6.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2476 -7.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9706 -6.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2576 -7.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0537 -8.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8773 -7.9872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4240 -7.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6003 -7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2948 -7.7911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2301 -8.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9673 -8.4533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6834 -8.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8598 -8.8203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5173 -5.9193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7645 -5.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2404 -5.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6981 -6.3068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9806 -6.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6937 -5.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4290 -7.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3234 -6.7045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7037 -5.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4998 -6.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4168 -5.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0465 -6.0631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3512 -3.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9810 -3.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5276 -3.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1573 -3.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3337 -3.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8804 -3.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4351 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0648 -3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3319 -3.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2076 -4.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 -3.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7541 -4.4249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6399 -3.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3487 -4.5621 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 11 12 1 0 0 0 0 12 13 2 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 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 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 27 34 1 0 0 0 0 34 35 1 0 0 0 0 25 36 1 0 0 0 0 20 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 38 46 1 0 0 0 0 46 47 1 0 0 0 0 18 48 1 0 0 0 0 13 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 10 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 9 53 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 7 55 1 0 0 0 0 55 56 1 0 0 0 0 5 56 1 0 0 0 0 56 57 1 0 0 0 0 5 58 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 2 60 1 0 0 0 0 60 61 1 0 0 0 0 M END > NP0243064 > NP-MRD > CC1C2C(CC3C4CC=C5CC(O)CC(OC6OCC(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C5(C)C4CCC23C)OC11OCC(C)C(O)C1O > InChI=1S/C43H68O18/c1-16-13-56-43(37(53)29(16)47)17(2)28-26(61-43)12-23-21-7-6-19-10-20(44)11-27(42(19,5)22(21)8-9-41(23,28)4)58-40-36(60-39-34(52)32(50)30(48)18(3)57-39)35(25(46)15-55-40)59-38-33(51)31(49)24(45)14-54-38/h6,16-18,20-40,44-53H,7-15H2,1-5H3 > FYVQLOJAISVVQU-UHFFFAOYSA-N > C43H68O18 > 872.999 > 872.44056535 > 18 > 129 > 92.06750267969957 > 0 > 10 > 0 > 0 > 14'-({5-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-3,4,16'-triol > -0.33 > -1.260775726333333 > -2.77 > 1 > 9 > 0 > 12.214176816588987 > 11.77034032428407 > -3.526580662123574 > 276.13999999999993 > 208.0228000000001 > 6 > 0 > 1.47e+00 g/l > 14'-({5-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-3,4,16'-triol > 0 > NP0243064 > 14'-({5-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-3,4,16'-triol $$$$