Mrv0541 02241212252D 93 98 0 0 0 0 999 V2000 -1.1196 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8341 1.4732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8341 0.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1196 0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4052 0.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4052 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1196 2.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 -0.5598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1196 -0.5893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3093 0.2357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3093 1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0238 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7382 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4527 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1672 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8816 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0238 0.6482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3106 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0251 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7395 1.4732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 -1.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1636 -1.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1636 -2.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 -3.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -2.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -1.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0202 -1.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -3.0348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5925 -2.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 -3.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5925 -1.7973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0215 -2.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7359 -3.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7359 -3.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0215 -4.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7359 -5.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0215 -5.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7359 -6.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0215 -6.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7359 -7.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0215 -7.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0202 -3.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -4.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -5.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0202 -5.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3057 -5.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3057 -4.2723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0202 -3.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 -3.8598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4786 -4.7732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6108 -5.6712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5912 -5.5098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 -6.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 -5.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5522 -5.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1623 -5.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1623 -6.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5522 -6.7474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9811 -6.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9811 -5.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5522 -4.2724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8768 -6.7473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5912 -6.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3057 -6.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0202 -6.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -6.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5764 -7.1598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3807 -8.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5764 -9.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9314 -8.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9314 -7.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6585 -5.4068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -5.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5865 -6.6162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -7.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3771 -7.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6626 -7.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 -6.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6585 -4.5818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 1.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5925 0.6777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5925 -0.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -0.5598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1636 -0.1473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1636 0.6777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4491 1.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 1.9152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 1.0902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 -0.5598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 0.6777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -1.3848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 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 1 7 1 0 0 0 0 3 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 6 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 1 0 0 0 0 12 18 2 0 0 0 0 17 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 23 24 1 0 0 0 0 23 28 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 27 28 1 0 0 0 0 28 29 1 0 0 0 0 23 8 1 0 0 0 0 25 30 1 0 0 0 0 26 51 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 34 32 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 39 37 1 0 0 0 0 36 37 1 0 0 0 0 39 38 1 0 0 0 0 38 40 1 0 0 0 0 43 41 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 44 49 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 44 50 1 0 0 0 0 45 51 1 0 0 0 0 46 52 1 0 0 0 0 47 53 1 0 0 0 0 48 54 1 0 0 0 0 55 56 1 0 0 0 0 55 60 1 0 0 0 0 55 61 1 0 0 0 0 56 57 1 0 0 0 0 56 62 1 0 0 0 0 57 58 1 0 0 0 0 57 63 1 0 0 0 0 59 60 1 0 0 0 0 54 58 1 0 0 0 0 64 65 1 0 0 0 0 64 59 1 0 0 0 0 58 59 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 80 1 0 0 0 0 65 69 1 0 0 0 0 73 69 1 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 74 75 1 0 0 0 0 75 76 1 0 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 78 79 1 0 0 0 0 79 80 1 0 0 0 0 74 81 2 0 0 0 0 74 53 1 0 0 0 0 82 83 1 0 0 0 0 82 87 1 0 0 0 0 82 89 1 0 0 0 0 83 84 1 0 0 0 0 83 90 1 0 0 0 0 84 85 1 0 0 0 0 84 91 1 0 0 0 0 85 86 1 0 0 0 0 86 87 1 0 0 0 0 87 88 1 0 0 0 0 88 92 1 0 0 0 0 85 93 1 0 0 0 0 24 93 1 0 0 0 0 M END > CHEM024053 > chemdb > CCCCCCCCCCCC(=O)OC1C(OC2C(C)OC3OC4C(O)C(O)C(C)OC4OC(CCCCC)CCCCCCCCCC(=O)OC3C2O)OC(C)C(OC2OC(C)C(OC(=O)CCCCCCCCC)C(O)C2O)C1OC1OC(CO)C(O)C(O)C1O > InChI=1S/C68H120O25/c1-8-11-14-16-18-19-23-27-33-38-48(72)89-63-62(93-65-54(78)51(75)50(74)45(39-69)86-65)59(91-64-55(79)53(77)57(41(5)82-64)87-46(70)36-31-26-21-17-15-12-9-2)43(7)84-68(63)90-58-42(6)83-67-61(56(58)80)88-47(71)37-32-28-24-20-22-25-30-35-44(34-29-13-10-3)85-66-60(92-67)52(76)49(73)40(4)81-66/h40-45,49-69,73-80H,8-39H2,1-7H3 > SNOPFOASRYQPCY-UHFFFAOYSA-N > C68H120O25 > 1337.6654 > 1336.81186939 > 22 > 150.61308157977967 > 0 > 9 > 0 > 0 > 5-{[5-(decanoyloxy)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-6-methyl-2-({7,25,26-trihydroxy-5,24-dimethyl-10-oxo-20-pentyl-2,4,9,21,23-pentaoxatricyclo[20.4.0.0³,⁸]hexacosan-6-yl}oxy)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl dodecanoate > 4.52 > 10.264218168333334 > -4.35 > 1 > 6 > 0 > 12.295912570390803 > 11.84179386963754 > -3.612479405917793 > 353.27 > 332.32539999999995 > 33 > 0 > 5.94e-02 g/l > 5-{[5-(decanoyloxy)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-6-methyl-2-({7,25,26-trihydroxy-5,24-dimethyl-10-oxo-20-pentyl-2,4,9,21,23-pentaoxatricyclo[20.4.0.0³,⁸]hexacosan-6-yl}oxy)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl dodecanoate > 0 > Operculin VII > 133019-98-4 $$$$