Mrv0541 05061312012D 64 70 0 0 0 0 999 V2000 11.4194 1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7813 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7505 -2.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8111 -2.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0027 -0.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4199 -0.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4057 1.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2541 2.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4338 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7182 0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7115 -2.2613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5715 -1.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8045 1.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4467 2.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2871 -0.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -1.8508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9289 -0.8723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6425 -6.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7113 -1.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8121 -4.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2289 -1.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1472 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4156 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8898 -6.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7136 -1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4809 -3.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9981 -1.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -0.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5692 -1.8430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9325 0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -5.8305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 -0.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2337 -4.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9024 -3.7527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4746 -5.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1425 -1.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8184 -2.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2273 -5.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 -1.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0657 -2.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6119 1.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2826 -2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0004 -1.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4293 -1.0259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1896 1.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1450 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2406 -0.2085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2211 -7.1343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 -0.5957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 -5.4929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4315 0.2253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -5.0565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6552 -4.0903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3906 -4.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8581 -0.6036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4872 -2.4488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4426 2.5618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9735 0.9893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3113 -6.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4247 -2.2496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8961 -5.2019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9817 -1.7736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3969 -3.0774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8536 -2.2535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10 9 1 0 0 0 0 13 8 2 0 0 0 0 14 8 1 0 0 0 0 15 12 1 0 0 0 0 16 11 1 0 0 0 0 22 9 1 0 0 0 0 23 17 1 0 0 0 0 24 18 1 0 0 0 0 25 19 1 0 0 0 0 26 20 1 0 0 0 0 27 11 1 0 0 0 0 28 10 1 0 0 0 0 29 12 1 0 0 0 0 30 22 1 0 0 0 0 30 23 1 0 0 0 0 31 24 1 0 0 0 0 32 25 1 0 0 0 0 33 26 1 0 0 0 0 34 33 1 0 0 0 0 35 31 1 0 0 0 0 36 32 1 0 0 0 0 37 34 1 0 0 0 0 38 35 1 0 0 0 0 39 36 1 0 0 0 0 40 37 1 0 0 0 0 41 1 1 0 0 0 0 41 2 1 0 0 0 0 41 13 1 0 0 0 0 42 3 1 0 0 0 0 42 4 1 0 0 0 0 42 27 1 0 0 0 0 42 29 1 0 0 0 0 43 5 1 0 0 0 0 43 15 1 0 0 0 0 43 27 1 0 0 0 0 43 28 1 0 0 0 0 44 6 1 0 0 0 0 44 16 1 0 0 0 0 44 28 1 0 0 0 0 45 7 1 0 0 0 0 45 14 1 0 0 0 0 45 30 1 0 0 0 0 46 17 1 0 0 0 0 46 21 1 0 0 0 0 46 22 1 0 0 0 0 46 44 1 0 0 0 0 47 23 2 0 0 0 0 48 24 1 0 0 0 0 49 25 1 0 0 0 0 50 31 1 0 0 0 0 51 32 1 0 0 0 0 52 33 1 0 0 0 0 53 34 1 0 0 0 0 54 35 1 0 0 0 0 55 36 1 0 0 0 0 56 37 1 0 0 0 0 57 41 1 0 0 0 0 58 45 1 0 0 0 0 59 18 1 0 0 0 0 59 38 1 0 0 0 0 60 19 1 0 0 0 0 60 39 1 0 0 0 0 61 20 1 0 0 0 0 61 38 1 0 0 0 0 62 21 1 0 0 0 0 62 40 1 0 0 0 0 63 26 1 0 0 0 0 63 40 1 0 0 0 0 64 29 1 0 0 0 0 64 39 1 0 0 0 0 M END > CHEM033813 > chemdb > CC(C)(O)\C=C\CC(C)(O)C1C2CCC3C4(C)CCC(OC5OCC(O)C(O)C5O)C(C)(C)C4CCC3(C)C2(COC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)CC1=O > InChI=1S/C46H76O18/c1-41(2,57)13-8-14-45(7,58)30-22-9-10-28-43(5)15-12-29(64-39-36(55)32(51)25(49)19-60-39)42(3,4)27(43)11-16-44(28,6)46(22,17-23(30)47)21-62-40-37(56)34(53)33(52)26(63-40)20-61-38-35(54)31(50)24(48)18-59-38/h8,13,22,24-40,48-58H,9-12,14-21H2,1-7H3/b13-8+ > RDSYZBZVCGNHLV-MDWZMJQESA-N > C46H76O18 > 917.0848 > 916.503165628 > 18 > 99.62869305009008 > 0 > 11 > 0 > 0 > 14-[(4E)-2,6-dihydroxy-6-methylhept-4-en-2-yl]-2,6,6,10-tetramethyl-11-{[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]methyl}-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-13-one > 0.67 > -0.6087518213333339 > -3.31 > 1 > 7 > 0 > 12.218653654974736 > 11.769396529940307 > -3.5265806236668267 > 294.98 > 225.27200000000005 > 12 > 0 > 4.51e-01 g/l > 14-[(4E)-2,6-dihydroxy-6-methylhept-4-en-2-yl]-2,6,6,10-tetramethyl-11-{[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]methyl}-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-13-one > 0 > Hoduloside VIII > 154971-12-7 $$$$