Mrv0541 02241209152D 66 74 0 0 0 0 999 V2000 -1.4152 1.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4152 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7011 0.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 1.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7011 2.1576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7245 0.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 1.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7245 2.1576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 2.1576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 3.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7245 2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9274 1.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4021 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9274 3.2268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2071 2.6516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 3.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0626 4.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2576 3.9602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1307 0.5091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1139 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2896 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2576 4.7858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 4.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2543 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9713 3.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6882 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9713 2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 1.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6168 1.7737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8477 0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5605 0.5091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2801 0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2801 -0.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5605 -1.1517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8477 -0.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1307 -1.1420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5605 -1.9773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9971 -1.1420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8087 -1.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0812 -2.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5377 -3.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7216 -3.2143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4562 -2.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9997 -1.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1795 -3.8377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8087 -4.1570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8931 -2.9075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1673 -2.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9971 -2.5800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4222 -3.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0645 -4.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2417 -4.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8164 -3.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5254 -4.6964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8673 -4.7858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9922 -3.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2478 -3.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3556 -2.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6882 -3.9533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9943 0.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7098 0.0990 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 37 65 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 44 1 0 0 0 0 42 53 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 52 1 0 0 0 0 46 47 1 0 0 0 0 46 51 1 0 0 0 0 47 48 1 0 0 0 0 47 50 1 0 0 0 0 48 49 1 0 0 0 0 48 63 1 0 0 0 0 53 54 1 0 0 0 0 53 58 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 55 62 1 0 0 0 0 56 57 1 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 57 60 1 0 0 0 0 58 61 1 0 0 0 0 62 64 1 0 0 0 0 65 66 1 0 0 0 0 M END > CHEM032411 > chemdb > CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CCC4C6C7(CC54CO7)OC(CC6(C)O)C=C(C)C)C3(C)C)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O > InChI=1S/C48H78O18/c1-21(2)15-23-16-46(8,58)39-24-9-10-28-44(6)13-12-29(43(4,5)27(44)11-14-45(28,7)47(24)19-48(39,66-23)59-20-47)63-42-38(65-40-35(56)33(54)30(51)22(3)60-40)37(32(53)26(18-50)62-42)64-41-36(57)34(55)31(52)25(17-49)61-41/h15,22-42,49-58H,9-14,16-20H2,1-8H3 > KACKPLBDQGQNSX-UHFFFAOYSA-N > C48H78O18 > 943.1221 > 942.518815692 > 18 > 102.25955995656642 > 0 > 10 > 0 > 0 > 2-[(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}-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol > 0.79 > 0.6557609300000022 > -3.30 > 1 > 9 > 0 > 12.375453926640006 > 11.88452804999239 > -3.0105410470324854 > 276.14 > 230.50760000000005 > 9 > 0 > 4.71e-01 g/l > 2-[(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}-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol > 0 > Hoduloside V > 146445-92-3 $$$$