Mrv1652309092217462D 34 36 0 0 0 0 999 V2000 4.5888 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5888 -2.9980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8263 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -4.4270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 -2.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3013 -2.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 -2.9980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 -1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -1.5691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3013 -0.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 -0.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -1.5691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -0.1401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 0.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 1.2888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3013 0.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 1.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9386 1.5710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8571 2.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 1.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9513 0.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7763 0.5743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1888 -0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0138 -0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7763 -0.8546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 -0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1263 -0.8546 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 7 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 2 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 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 9 16 1 0 0 0 0 16 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 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 29 30 1 0 0 0 0 29 31 2 0 0 0 0 27 32 1 0 0 0 0 32 33 1 0 0 0 0 22 33 1 0 0 0 0 14 33 1 0 0 0 0 33 34 1 0 0 0 0 M END > NP0286952 > NP-MRD > CC(=O)OCC(CO)C1=C(O)C(O)=C2C(=C1O)C(=O)C(O)=C1C(C)(C)CC(CC21C)OC(C)=O > InChI=1S/C24H30O10/c1-10(26)33-9-12(8-25)14-17(28)15-16(20(31)18(14)29)24(5)7-13(34-11(2)27)6-23(3,4)22(24)21(32)19(15)30/h12-13,25,28-29,31-32H,6-9H2,1-5H3 > BLLJRCSMXYBSCC-UHFFFAOYSA-N > C24H30O10 > 478.494 > 478.183897166 > 8 > 64 > 48.70804775082752 > 1 > 5 > 0 > 1 > 2-[6-(acetyloxy)-1,3,4,9-tetrahydroxy-4b,8,8-trimethyl-10-oxo-4b,5,6,7,8,10-hexahydrophenanthren-2-yl]-3-hydroxypropyl acetate > 1.3291943113333338 > 1 > 3 > 0 > 8.98511569390062 > 7.571958123408324 > -2.732394946271408 > 170.82 > 120.90419999999999 > 7 > 1 > 2-[6-(acetyloxy)-1,3,4,9-tetrahydroxy-4b,8,8-trimethyl-10-oxo-6,7-dihydro-5H-phenanthren-2-yl]-3-hydroxypropyl acetate > 0 > NP0286952 > 2-[6-(acetyloxy)-1,3,4,9-tetrahydroxy-4b,8,8-trimethyl-10-oxo-6,7-dihydro-5h-phenanthren-2-yl]-3-hydroxypropyl acetate $$$$