Mrv1533004171507552D 57 64 0 0 0 0 999 V2000 4.8579 4.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0031 3.9282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 3.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4619 4.1109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 3.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9057 3.8338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5005 3.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 3.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3029 2.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8329 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2959 2.1457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0083 2.8554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 2.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7313 1.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0484 0.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3971 1.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1995 0.6540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 1.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3047 0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4926 0.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9608 1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1486 0.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4327 0.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4352 0.4599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4372 -0.3651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 1.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8971 2.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7092 2.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 1.7952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5214 2.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0532 1.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 2.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1456 2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6774 2.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0373 2.9732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1953 1.3596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7271 1.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5392 1.8451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0711 2.4758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8832 2.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1635 1.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9756 1.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2559 0.6335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 0.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3483 -0.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5998 1.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4120 0.9738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3195 1.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8514 2.5256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5074 2.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2271 2.8160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7908 3.2517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3226 3.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9786 3.3969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6983 4.1728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4468 2.7662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3653 2.9114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 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 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 5 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 3 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 16 18 1 0 0 0 0 18 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 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 22 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 21 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 18 31 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 13 34 1 0 0 0 0 16 34 1 0 0 0 0 34 35 1 0 0 0 0 26 36 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 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 42 50 1 0 0 0 0 50 51 1 0 0 0 0 39 52 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 37 56 1 0 0 0 0 56 57 1 0 0 0 0 M END > NP0183293 > NP-MRD > COC1OC(C=C(C)C)C(O)C1C1CCC2(C)C3CCC4C5(CC35CCC12C)CCC(OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O)C4(C)CO > InChI=1S/C43H70O14/c1-20(2)16-23-30(46)28(36(52-7)55-23)22-10-12-41(6)26-9-8-25-39(4,19-44)27(11-13-42(25)18-43(26,42)15-14-40(22,41)5)57-38-35(51)33(49)31(47)24(56-38)17-53-37-34(50)32(48)29(45)21(3)54-37/h16,21-38,44-51H,8-15,17-19H2,1-7H3 > RNOZUUHMHSYDAH-UHFFFAOYSA-N > C43H70O14 > 811.019 > 810.476556934 > 14 > 127 > 89.95068815564272 > 0 > 8 > 0 > 0 > 2-({15-[4-hydroxy-2-methoxy-5-(2-methylprop-1-en-1-yl)oxolan-3-yl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl}oxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol > 1.37 > 1.6950248896666682 > -3.92 > 1 > 8 > 0 > 12.427844567234153 > 11.9102577890091 > -2.785735856040292 > 217.21999999999997 > 203.7849 > 9 > 0 > 9.65e-02 g/l > 2-({15-[4-hydroxy-2-methoxy-5-(2-methylprop-1-en-1-yl)oxolan-3-yl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl}oxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol > 0 > NP0183293 > 2-({15-[4-hydroxy-2-methoxy-5-(2-methylprop-1-en-1-yl)oxolan-3-yl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl}oxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol $$$$