Mrv1652309092222122D 44 46 0 0 1 0 999 V2000 -1.1610 2.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7741 1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5587 2.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7302 2.8499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1718 1.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9564 1.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0002 0.6839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6133 0.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4203 0.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7559 1.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8328 -0.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2808 -1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5271 -0.6886 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8126 -1.1011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0982 -0.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0982 0.1364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3837 -1.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6692 -0.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0453 -1.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7597 -0.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4742 -1.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4159 -1.8380 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1846 -2.6299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5924 -1.7887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1379 -2.4772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3144 -2.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5069 -3.2150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1365 -2.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8999 -1.9269 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5130 -2.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3414 -3.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9545 -3.8379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5568 -3.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3853 -4.3478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6007 -4.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1312 -1.1350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7189 -1.7140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6563 -0.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1512 0.1997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9319 -0.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6065 0.4080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9196 -0.8918 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7376 -0.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2517 -1.6470 0.0000 O 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 3 4 1 0 0 0 0 3 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 11 12 1 0 0 0 0 12 13 1 0 0 0 0 8 13 1 0 0 0 0 13 14 1 6 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 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 1 0 0 0 0 12 22 1 0 0 0 0 22 23 1 6 0 0 0 22 24 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 22 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 6 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 29 36 1 0 0 0 0 36 37 1 6 0 0 0 36 38 1 0 0 0 0 11 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 36 42 1 0 0 0 0 42 43 1 6 0 0 0 42 44 1 1 0 0 0 M END > NP0289822 > NP-MRD > CCCCCC(=O)O[C@H]1C(OC(=O)C(\C)=C\C)C(C)=C2C3OC(=O)[C@](C)(O)[C@]3(O)[C@H](C[C@](C)(OC(C)=O)C12)OC(=O)CCC > InChI=1S/C32H46O12/c1-9-12-13-15-22(35)41-26-24-23(18(5)25(26)42-28(36)17(4)11-3)27-32(39,31(8,38)29(37)43-27)20(40-21(34)14-10-2)16-30(24,7)44-19(6)33/h11,20,24-27,38-39H,9-10,12-16H2,1-8H3/b17-11+/t20-,24?,25?,26+,27?,30-,31-,32-/m0/s1 > LXWLOFYIORKNSA-VPFCRTNDSA-N > C32H46O12 > 622.708 > 622.298926921 > 7 > 90 > 65.18432365083619 > 0 > 2 > 0 > 0 > (3R,3aS,4S,6S,7R)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,3H,3aH,4H,5H,6H,6aH,7H,8H,9bH-azuleno[4,5-b]furan-7-yl hexanoate > 3.4953881656666645 > 1 > 3 > 0 > 12.498704796841494 > 11.135565750741481 > -4.307623186172571 > 171.96 > 154.61380000000003 > 15 > 0 > (3R,3aS,4S,6S,7R)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-{[(2E)-2-methylbut-2-enoyl]oxy}-2-oxo-4H,5H,6aH,7H,8H,9bH-azuleno[4,5-b]furan-7-yl hexanoate > 0 > NP0289822 > (3r,3as,4s,6s,7r)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-{[(2e)-2-methylbut-2-enoyl]oxy}-2-oxo-4h,5h,6ah,7h,8h,9bh-azuleno[4,5-b]furan-7-yl hexanoate $$$$