Mrv0541 05061309292D 84 93 0 0 0 0 999 V2000 -0.8185 6.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0420 -2.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8565 7.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7959 7.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5696 1.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 1.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7539 4.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8973 3.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1884 4.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1828 5.3921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4683 4.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4683 2.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3249 3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0394 4.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1828 2.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0407 6.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6117 3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0407 5.3920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3262 4.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6117 6.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 -1.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4696 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8185 4.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5329 6.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3275 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8973 4.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6118 5.3921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4696 -1.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4696 2.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5329 3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7539 2.9170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4683 4.1546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3249 2.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 6.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3275 -3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 2.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5329 2.9170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9619 6.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6131 -4.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 3.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 -1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8185 2.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9619 5.3920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 -3.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4697 3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 -0.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 -1.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 2.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 4.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 3.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0407 4.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3262 6.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0394 2.5045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7539 3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8973 4.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1828 3.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3262 4.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0407 -1.2079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 7.4546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0420 -4.0954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 2.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 2.5045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6764 6.6296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -4.9204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8986 3.7420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6131 -1.6205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8185 1.6796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6763 4.9795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 -4.0954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4696 4.5671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6131 0.0296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 4.9796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 0.8545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 3.7420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 5.3921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -2.4454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4696 -0.3829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2474 4.1546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 2.5045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6105 2.5046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1841 -2.4455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0407 3.7421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11 10 1 0 0 0 0 14 13 1 0 0 0 0 15 12 1 0 0 0 0 18 16 1 0 0 0 0 19 17 1 0 0 0 0 24 1 1 0 0 0 0 25 2 1 0 0 0 0 26 10 2 0 0 0 0 27 20 1 0 0 0 0 27 26 1 0 0 0 0 28 21 1 0 0 0 0 29 22 1 0 0 0 0 30 23 1 0 0 0 0 31 12 1 0 0 0 0 32 11 1 0 0 0 0 33 13 1 0 0 0 0 34 24 1 0 0 0 0 35 25 1 0 0 0 0 36 29 1 0 0 0 0 37 30 1 0 0 0 0 38 34 1 0 0 0 0 39 35 1 0 0 0 0 40 36 1 0 0 0 0 42 37 1 0 0 0 0 43 38 1 0 0 0 0 44 39 1 0 0 0 0 45 40 1 0 0 0 0 46 41 1 0 0 0 0 47 28 1 0 0 0 0 47 41 1 0 0 0 0 48 46 1 0 0 0 0 49 42 1 0 0 0 0 50 43 1 0 0 0 0 51 44 1 0 0 0 0 52 45 1 0 0 0 0 54 3 1 0 0 0 0 54 4 1 0 0 0 0 54 16 1 0 0 0 0 54 20 1 0 0 0 0 55 5 1 0 0 0 0 55 6 1 0 0 0 0 55 31 1 0 0 0 0 55 33 1 0 0 0 0 56 7 1 0 0 0 0 56 14 1 0 0 0 0 56 31 1 0 0 0 0 56 32 1 0 0 0 0 57 8 1 0 0 0 0 57 17 1 0 0 0 0 57 26 1 0 0 0 0 58 9 1 0 0 0 0 58 15 1 0 0 0 0 58 32 1 0 0 0 0 58 57 1 0 0 0 0 59 18 1 0 0 0 0 59 19 1 0 0 0 0 59 27 1 0 0 0 0 59 53 1 0 0 0 0 60 21 1 0 0 0 0 61 34 1 0 0 0 0 62 35 1 0 0 0 0 63 36 1 0 0 0 0 64 37 1 0 0 0 0 65 38 1 0 0 0 0 66 39 1 0 0 0 0 67 40 1 0 0 0 0 68 41 1 0 0 0 0 69 42 1 0 0 0 0 70 43 1 0 0 0 0 71 44 1 0 0 0 0 72 45 1 0 0 0 0 73 46 1 0 0 0 0 74 53 2 0 0 0 0 75 22 1 0 0 0 0 75 48 1 0 0 0 0 76 23 1 0 0 0 0 76 49 1 0 0 0 0 77 24 1 0 0 0 0 77 50 1 0 0 0 0 78 25 1 0 0 0 0 78 51 1 0 0 0 0 79 28 1 0 0 0 0 79 48 1 0 0 0 0 80 30 1 0 0 0 0 80 50 1 0 0 0 0 81 29 1 0 0 0 0 81 52 1 0 0 0 0 82 33 1 0 0 0 0 82 49 1 0 0 0 0 83 47 1 0 0 0 0 83 51 1 0 0 0 0 84 52 1 0 0 0 0 84 53 1 0 0 0 0 M END > CHEM030607 > chemdb > CC1OC(OC2COC(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(CCC54C)C(=O)OC4OC(COC5OC(CO)C(OC6OC(C)C(O)C(O)C6O)C(O)C5O)C(O)C(O)C4O)C3(C)C)C(O)C2O)C(O)C(O)C1O > InChI=1S/C59H96O25/c1-24-34(61)38(65)43(70)50(77-24)80-30-23-76-49(42(69)37(30)64)82-33-13-14-56(7)31(55(33,5)6)12-15-58(9)32(56)11-10-26-27-20-54(3,4)16-18-59(27,19-17-57(26,58)8)53(74)84-52-45(72)40(67)36(63)29(81-52)22-75-48-46(73)41(68)47(28(21-60)79-48)83-51-44(71)39(66)35(62)25(2)78-51/h10,24-25,27-52,60-73H,11-23H2,1-9H3 > HIFPOHSXFYSEJA-UHFFFAOYSA-N > C59H96O25 > 1205.3785 > 1204.624068622 > 24 > 127.50060960023691 > 0 > 14 > 0 > 0 > 6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 10-({3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate > 1.27 > -0.03242236733333617 > -3.39 > 1 > 10 > 0 > 12.006966291496369 > 11.611303473159532 > -3.679025732357002 > 392.59000000000015 > 286.6589999999999 > 13 > 0 > 4.86e-01 g/l > 6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 10-({3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylate > 0 > Eleutheroside L > 35790-96-6 $$$$