Mrv0541 05061308412D 83 93 0 0 0 0 999 V2000 -0.8289 2.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8289 1.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1149 1.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 1.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 2.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1149 3.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 1.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0246 1.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0246 2.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 3.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 3.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 3.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0246 4.3947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 3.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5134 2.9169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9881 3.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5134 4.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7929 3.6613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1246 4.3947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6485 5.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8436 4.9698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5435 1.5194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5277 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2965 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 3.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0246 3.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8436 5.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 5.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9455 4.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4272 3.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2481 3.8896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 3.0552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 2.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2028 2.7835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5437 0.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8293 0.2817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8295 -0.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5441 -0.9556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2585 -0.5429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2583 0.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9726 0.6947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -0.9553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5443 -1.7806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9732 -1.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6878 -2.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -3.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9736 -3.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2591 -3.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2589 -2.1929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5447 -3.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8301 -3.0183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9738 -4.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4026 -3.4299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4022 -1.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1167 -2.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8311 -1.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5457 -2.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5459 -3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8315 -3.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1170 -3.0172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2605 -3.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8309 -0.9546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2601 -1.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9724 1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 1.9321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2576 2.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 3.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6866 2.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6868 1.9324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9718 3.9947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4009 3.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4014 1.5201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1158 -3.4310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -4.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5984 -4.6687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -4.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3132 -3.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5988 -3.0187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8305 -4.6683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5982 -5.4937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0273 -4.6690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0278 -3.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -2.1940 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 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 25 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 9 11 1 0 0 0 0 9 26 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 21 27 1 0 0 0 0 21 28 1 0 0 0 0 22 35 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 35 40 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 38 43 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 41 64 1 0 0 0 0 42 44 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 45 54 1 0 0 0 0 46 47 1 0 0 0 0 46 53 1 0 0 0 0 47 48 1 0 0 0 0 47 52 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 50 51 1 0 0 0 0 51 73 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 60 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 58 59 1 0 0 0 0 58 61 1 0 0 0 0 59 60 1 0 0 0 0 64 65 1 0 0 0 0 64 69 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 67 70 1 0 0 0 0 68 69 1 0 0 0 0 68 71 1 0 0 0 0 69 72 1 0 0 0 0 73 74 1 0 0 0 0 73 78 1 0 0 0 0 74 75 1 0 0 0 0 74 79 1 0 0 0 0 75 76 1 0 0 0 0 75 80 1 0 0 0 0 76 77 1 0 0 0 0 76 81 1 0 0 0 0 77 78 1 0 0 0 0 77 82 1 0 0 0 0 82 83 1 0 0 0 0 M END > CHEM029632 > chemdb > CC(C)=CC1CC(C)(O)C2C3CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C33COC2(C3)O1 > InChI=1S/C57H92O26/c1-23(2)14-24-15-55(7,71)46-25-8-9-32-53(5)12-11-33(52(3,4)31(53)10-13-54(32,6)56(25)21-57(46,83-24)76-22-56)79-50-45(82-49-41(69)35(63)27(60)18-73-49)43(28(61)19-74-50)80-51-44(81-48-40(68)34(62)26(59)17-72-48)39(67)37(65)30(78-51)20-75-47-42(70)38(66)36(64)29(16-58)77-47/h14,24-51,58-71H,8-13,15-22H2,1-7H3 > UOTFAVQIRLMJFF-UHFFFAOYSA-N > C57H92O26 > 1193.3248 > 1192.587683116 > 26 > 125.22295050927599 > 0 > 14 > 0 > 0 > 2-({3,4-dihydroxy-6-[(5-hydroxy-2-{[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-en-1-yl)-19,21-dioxahexacyclo[18.2.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]tricosan-7-yl]oxy}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-4-yl)oxy]-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol > -0.34 > -2.0418155020000013 > -2.72 > 1 > 11 > 0 > 12.187300643911128 > 11.753824416232252 > -3.6489650577912593 > 393.9800000000001 > 278.99039999999997 > 13 > 0 > 2.30e+00 g/l > 2-({3,4-dihydroxy-6-[(5-hydroxy-2-{[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-en-1-yl)-19,21-dioxahexacyclo[18.2.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]tricosan-7-yl]oxy}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-4-yl)oxy]-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol > 0 > Hovenoside D > 68144-22-9 $$$$