Mrv1533004201500282D 56 63 0 0 0 0 999 V2000 1.8747 3.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6618 2.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9132 2.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5188 2.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8451 1.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6794 1.4108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1744 2.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9934 1.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3175 1.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1366 1.1148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8125 1.8734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6316 1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4507 1.6761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9457 2.3361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7748 0.9175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5939 0.8188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0888 1.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7647 2.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2597 2.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9356 3.6562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1165 3.7548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7924 4.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9734 4.6122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6493 5.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1442 6.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8201 6.7895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9633 5.9322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4583 6.5922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2874 5.1735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1065 5.0749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0788 2.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5738 3.4589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4029 2.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2220 1.9415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9079 1.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 0.6215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2798 0.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0404 -0.5321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0157 -0.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0608 -0.9392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4607 0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9657 -0.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1467 -0.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8226 0.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3276 -0.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 0.6521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8268 -0.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5147 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6929 0.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2241 -0.6156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 0.8164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7875 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1686 1.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8648 0.8997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5438 0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4879 -0.4666 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 2 4 1 0 0 0 0 4 5 1 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 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 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 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 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 22 29 1 0 0 0 0 29 30 1 0 0 0 0 19 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 17 35 1 0 0 0 0 35 36 1 0 0 0 0 15 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 37 41 1 0 0 0 0 10 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 9 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 6 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 5 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 2 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 51 55 1 0 0 0 0 55 56 2 0 0 0 0 M END > NP0327745 > NP-MRD > CC1(C)CC2C3=CCC4C5(C)CC(O)C(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C22CC1OC2=O > InChI=1S/C41H64O15/c1-36(2)11-19-18-7-8-24-37(3)12-20(43)32(56-34-31(50)29(48)28(47)22(54-34)16-53-33-30(49)27(46)21(44)15-52-33)38(4,17-42)23(37)9-10-39(24,5)40(18,6)13-25(45)41(19)14-26(36)55-35(41)51/h7,19-34,42-50H,8-17H2,1-6H3 > SDSYRQGZGQLKOP-UHFFFAOYSA-N > C41H64O15 > 796.948 > 796.424521361 > 14 > 120 > 84.78810558009249 > 0 > 9 > 0 > 0 > 2,11-dihydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-10-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-16-en-23-one > 0.81 > -0.46932868899999947 > -3.11 > 1 > 8 > 0 > 12.452293087965803 > 11.923993547391362 > -3.06012192753698 > 245.28999999999996 > 195.1636000000001 > 6 > 0 > 6.24e-01 g/l > 2,11-dihydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-10-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-16-en-23-one > 0 > NP0327745 > 2,11-dihydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-10-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-16-en-23-one $$$$