Mrv1533004251513492D 35 37 0 0 0 0 999 V2000 1.4913 -4.7812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0514 -4.0832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2271 -4.1151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -3.3533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9962 -2.6554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3807 -1.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0328 -2.4309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 -1.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4206 -0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0316 -0.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 0.4935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8172 -0.5648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5828 0.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3387 0.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9891 0.8217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1637 0.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5299 0.8044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -0.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4933 -0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9243 0.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -1.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6112 -1.4755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1817 -1.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -1.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7218 -2.5623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9917 -1.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -2.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3858 -3.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9105 -2.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2557 -2.2577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0159 -2.2278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8014 -1.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4124 -2.5302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -1.1696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 18 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 6 27 1 0 0 0 0 12 27 1 0 0 0 0 24 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 8 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 M END > NP0329286 > NP-MRD > CC(=O)OCC1(O)C(CC(O)C2(C)C1C(O)C1(CC(O)C(C)=C1C(O)C2O)C(C)(C)O)OC(C)=O > InChI=1S/C24H38O11/c1-10-13(27)8-23(21(4,5)32)16(10)17(29)19(30)22(6)14(28)7-15(35-12(3)26)24(33,9-34-11(2)25)18(22)20(23)31/h13-15,17-20,27-33H,7-9H2,1-6H3 > LEVXPEGBYHJFIK-UHFFFAOYSA-N > C24H38O11 > 502.557 > 502.241412044 > 9 > 73 > 50.84527057449561 > 0 > 7 > 0 > 0 > [6-(acetyloxy)-2,4,5,8,9,10-hexahydroxy-3a-(2-hydroxypropan-2-yl)-1,8a-dimethyl-2H,3H,3aH,4H,4aH,5H,6H,7H,8H,8aH,9H,10H-cyclohexa[f]azulen-5-yl]methyl acetate > -0.54 > -3.6206607789999996 > -1.99 > 1 > 3 > 0 > 13.285710035120669 > 12.591777109895606 > -2.9517057367530626 > 194.20999999999998 > 120.07990000000001 > 6 > 0 > 5.14e+00 g/l > [6-(acetyloxy)-2,4,5,8,9,10-hexahydroxy-3a-(2-hydroxypropan-2-yl)-1,8a-dimethyl-2H,3H,4H,4aH,6H,7H,8H,9H,10H-cyclohexa[f]azulen-5-yl]methyl acetate > 0 > NP0329286 > [6-(acetyloxy)-2,4,5,8,9,10-hexahydroxy-3a-(2-hydroxypropan-2-yl)-1,8a-dimethyl-2h,3h,4h,4ah,6h,7h,8h,9h,10h-cyclohexa[f]azulen-5-yl]methyl acetate $$$$