Mrv1652309072217332D 50 51 0 0 0 0 999 V2000 4.0520 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8559 -1.3877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4518 -1.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -1.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7775 -1.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5464 -1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3712 -1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6702 -0.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9671 -1.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2994 -2.6367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1048 -2.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3174 -3.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1299 -3.6047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0184 -4.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6143 -4.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2632 -4.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6928 -5.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8713 -5.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9238 -4.8596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -4.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -5.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5031 -4.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8273 -4.7803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1708 -3.5519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1528 -2.7271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3404 -2.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0582 -1.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8101 -3.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0922 -3.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9976 -3.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7154 -2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4673 -3.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -3.0726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1818 -4.1171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1818 -4.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8962 -5.3546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8962 -6.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1818 -6.5921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6107 -6.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6107 -7.4171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3252 -7.8296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3252 -8.6546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0396 -7.4171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4673 -5.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4673 -6.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7528 -4.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0384 -5.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6761 -4.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0384 -6.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7528 -4.1171 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 2 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 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 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 3 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 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 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 35 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 47 48 1 0 0 0 0 47 49 1 0 0 0 0 46 50 1 0 0 0 0 32 50 1 0 0 0 0 M END > NP0252137 > NP-MRD > COC1\C=C\C=C(C)\CC(C)C(O)C(C)\C=C(/C)\C=C(C)\C(=O)OC1C(C)C(O)C(C)C1(O)CC(OC(=O)\C=C\C(O)=O)C(C)C(O1)C(C)C > InChI=1S/C39H60O11/c1-21(2)36-27(8)31(48-33(42)16-15-32(40)41)20-39(46,50-36)29(10)35(44)28(9)37-30(47-11)14-12-13-22(3)17-24(5)34(43)25(6)18-23(4)19-26(7)38(45)49-37/h12-16,18-19,21,24-25,27-31,34-37,43-44,46H,17,20H2,1-11H3,(H,40,41)/b14-12+,16-15+,22-13+,23-18+,26-19+ > PQLOHEMXTLVMFP-NOUMOCAESA-N > C39H60O11 > 704.898 > 704.413562752 > 9 > 110 > 77.26111810014285 > 0 > 4 > 0 > 0 > (2E)-4-[(2-hydroxy-2-{3-hydroxy-4-[(4E,6E,12E,14E)-10-hydroxy-3-methoxy-7,9,11,13,15-pentamethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl}-5-methyl-6-(propan-2-yl)oxan-4-yl)oxy]-4-oxobut-2-enoic acid > 6.739793830999998 > 0 > 2 > -1 > 11.68823575176314 > 3.2176084518199444 > -0.7344805987174386 > 169.04999999999995 > 193.28150000000008 > 10 > 0 > (2E)-4-[(2-hydroxy-2-{3-hydroxy-4-[(4E,6E,12E,14E)-10-hydroxy-3-methoxy-7,9,11,13,15-pentamethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl}-6-isopropyl-5-methyloxan-4-yl)oxy]-4-oxobut-2-enoic acid > 0 > NP0252137 > (2e)-4-[(2-hydroxy-2-{3-hydroxy-4-[(4e,6e,12e,14e)-10-hydroxy-3-methoxy-7,9,11,13,15-pentamethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl}-6-isopropyl-5-methyloxan-4-yl)oxy]-4-oxobut-2-enoic acid $$$$