Mrv1652309052219532D 27 28 0 0 0 0 999 V2000 2.0329 -5.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -4.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -4.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -3.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -3.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -3.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -2.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -1.8711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8724 -2.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6974 -2.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1099 -1.5691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9349 -1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3474 -0.8546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3474 -2.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9349 -2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1099 -2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6974 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8724 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4599 -2.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4599 -4.4270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -4.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -5.5539 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 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 10 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 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 13 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 7 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 M END > NP0217519 > NP-MRD > CC(OC(C)=O)C(OC(C)=O)\C=C\C1OC1C1OC(=O)C=CC1OC(C)=O > InChI=1S/C18H22O9/c1-9(23-10(2)19)13(24-11(3)20)5-6-15-17(26-15)18-14(25-12(4)21)7-8-16(22)27-18/h5-9,13-15,17-18H,1-4H3/b6-5+ > WSMOXQBLJXEQNX-AATRIKPKSA-N > C18H22O9 > 382.365 > 382.126382288 > 5 > 49 > 37.49400311207543 > 1 > 0 > 0 > 1 > (1E)-4-(acetyloxy)-1-{3-[3-(acetyloxy)-6-oxo-3,6-dihydro-2H-pyran-2-yl]oxiran-2-yl}pent-1-en-3-yl acetate > 0.8138113799999988 > 0 > 2 > 0 > 12.257253985982892 > -4.249076472482567 > 117.73000000000002 > 89.74170000000001 > 10 > 1 > (1E)-4-(acetyloxy)-1-{3-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]oxiran-2-yl}pent-1-en-3-yl acetate > 0 > NP0217519 > (1e)-4-(acetyloxy)-1-{3-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]oxiran-2-yl}pent-1-en-3-yl acetate $$$$