Mrv1652305302218462D 38 40 0 0 0 0 999 V2000 -2.1774 1.7700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8953 0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1808 1.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4663 0.9947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2481 1.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2481 2.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9626 0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6771 1.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3915 0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 1.4072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3915 0.1697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7077 0.8515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9899 0.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4596 -0.5558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6471 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9293 -1.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 0.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 0.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 -0.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3044 -0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2259 -1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1168 -1.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -1.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8687 -2.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1509 -3.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6895 -3.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1975 -4.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9727 -4.2789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9439 -3.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -2.9464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 1.4835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9559 2.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 2.4020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4862 2.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 3.6659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7343 4.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5468 4.1547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4521 5.0732 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 2 0 0 0 0 5 7 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 2 0 0 0 0 2 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 15 17 1 0 0 0 0 2 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 15 22 1 0 0 0 0 23 22 1 4 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 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 25 29 1 0 0 0 0 29 30 2 0 0 0 0 12 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 M END > NP0137234 > NP-MRD > CC1(COC(=O)CCC(O)=O)C(CCC2(C)C1CCC(=C)C2C=CC1=CCOC1=O)OC(=O)CCC(O)=O > InChI=1S/C28H36O10/c1-17-4-7-20-27(2,19(17)6-5-18-13-15-36-26(18)35)14-12-21(38-25(34)11-9-23(31)32)28(20,3)16-37-24(33)10-8-22(29)30/h5-6,13,19-21H,1,4,7-12,14-16H2,2-3H3,(H,29,30)(H,31,32) > YTHKMAIVPFVDNU-UHFFFAOYSA-N > C28H36O10 > 532.586 > 532.230847359 > 7 > 74 > 55.45396014713381 > 0 > 2 > 0 > 0 > 4-[(1-{[(3-carboxypropanoyl)oxy]methyl}-1,4a-dimethyl-6-methylidene-5-[2-(2-oxo-2,5-dihydrofuran-3-yl)ethenyl]-decahydronaphthalen-2-yl)oxy]-4-oxobutanoic acid > 2.907279937666665 > 1 > 3 > -2 > 4.345639270814703 > 3.73737498804788 > -6.529012675159145 > 153.5 > 134.77519999999998 > 13 > 0 > 4-[(1-{[(3-carboxypropanoyl)oxy]methyl}-1,4a-dimethyl-6-methylidene-5-[2-(2-oxo-5H-furan-3-yl)ethenyl]-hexahydro-2H-naphthalen-2-yl)oxy]-4-oxobutanoic acid > 0 > NP0137234 > Dehydroandrographolide succinate $$$$