Mrv1533004241511102D 64 72 0 0 0 0 999 V2000 4.0713 -1.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8854 -1.7420 0.0000 O 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 6.4540 -3.6564 0.0000 C 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 5.1170 -3.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -3.2858 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 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 11.3512 -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 7.9405 -3.9013 0.0000 O 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 13.8221 -2.9224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2754 -3.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0990 -3.5638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5523 -4.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3759 -4.2051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7462 -3.4679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1820 -4.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6353 -5.6796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4589 -5.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8292 -4.8944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6528 -4.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0231 -4.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1062 -5.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9298 -5.4878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7359 -6.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1892 -6.9623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9123 -6.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5420 -7.0582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3584 -5.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9881 -5.7755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9051 -4.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0815 -4.3969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7112 -5.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1645 -5.8234 0.0000 O 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 C 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 11.6003 -7.3458 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 10.6937 -5.9672 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 11.4343 -4.4928 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 3 8 1 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 11 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 16 17 2 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 17 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 14 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 13 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 11 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 5 31 1 0 0 0 0 31 32 1 0 0 0 0 19 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 41 49 1 0 0 0 0 49 50 1 0 0 0 0 39 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 34 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 56 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 59 61 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 55 63 1 0 0 0 0 63 64 1 0 0 0 0 M END > NP0257844 > NP-MRD > COC1OC2(CCC1C)OC1CC3C4CC=C5CC(CCC5(C)C4CCC3(C)C1(O)C2C)OC1OC(CO)C(OC2OC(C)C(O)C(O)C2O)C(O)C1OC1OC(C)C(O)C(O)C1O > InChI=1S/C46H74O18/c1-19-10-15-45(64-39(19)56-7)22(4)46(55)29(63-45)17-27-25-9-8-23-16-24(11-13-43(23,5)26(25)12-14-44(27,46)6)59-42-38(62-41-35(53)33(51)31(49)21(3)58-41)36(54)37(28(18-47)60-42)61-40-34(52)32(50)30(48)20(2)57-40/h8,19-22,24-42,47-55H,9-18H2,1-7H3 > KNFFNNXVQUAVOB-UHFFFAOYSA-N > C46H74O18 > 915.08 > 914.487515543 > 18 > 138 > 99.56485298056096 > 0 > 9 > 0 > 0 > 2-{[4-hydroxy-2-(hydroxymethyl)-6-{6-methoxy-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-8'-oloxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol > 1.24 > 1.2088108553333377 > -3.19 > 1 > 9 > 0 > 12.329204673920906 > 11.861597785199764 > -3.6084858966486024 > 265.14 > 221.19100000000003 > 8 > 0 > 5.90e-01 g/l > 2-{[4-hydroxy-2-(hydroxymethyl)-6-{6-methoxy-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-8'-oloxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol > 0 > NP0257844 > 2-{[4-hydroxy-2-(hydroxymethyl)-6-{6-methoxy-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-8'-oloxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol $$$$