Mrv1652309082217322D 28 30 0 0 1 0 999 V2000 7.6573 -1.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8323 -1.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4182 -2.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4214 -0.9133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5964 -0.9114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1855 -0.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3652 -0.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1955 0.6994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 1.2528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7633 1.3409 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5936 2.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 0.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7107 0.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8804 -0.6303 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1650 -1.0412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5683 0.2449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 -1.1837 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6620 -1.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7769 -1.5946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3126 -1.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.8609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6398 -1.4143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4665 -2.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0783 -2.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6813 -2.4741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9109 1.1103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5227 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7266 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 6 7 2 0 0 0 0 8 7 1 4 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 1 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 1 0 0 0 14 16 1 0 0 0 0 10 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 6 0 0 0 17 19 1 1 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 7 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 8 26 1 0 0 0 0 26 27 1 0 0 0 0 6 27 1 0 0 0 0 27 28 2 0 0 0 0 M END > NP0269907 > NP-MRD > CC(=O)OCC1=C2C(C[C@@](C)(O)[C@]3(O)CC[C@@](C)(O3)C=C2OC1=O)OC(C)=O > InChI=1S/C19H24O9/c1-10(20)25-9-12-15-13(27-16(12)22)7-17(3)5-6-19(24,28-17)18(4,23)8-14(15)26-11(2)21/h7,14,23-24H,5-6,8-9H2,1-4H3/t14?,17-,18-,19+/m1/s1 > GSADBENAXUTZTK-LAHNRMPYSA-N > C19H24O9 > 396.392 > 396.142032353 > 6 > 52 > 38.55765416314507 > 1 > 2 > 0 > 0 > [(1R,10R,11S)-8-(acetyloxy)-10,11-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0^{3,7}]tetradeca-2,6-dien-6-yl]methyl acetate > -0.5486016200000002 > 0 > 3 > 0 > 13.854339515044455 > 10.972760084691878 > -3.651119302102699 > 128.59000000000003 > 94.96559999999998 > 5 > 1 > [(1R,10R,11S)-8-(acetyloxy)-10,11-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0^{3,7}]tetradeca-2,6-dien-6-yl]methyl acetate > 0 > NP0269907 > [(1r,10r,11s)-8-(acetyloxy)-10,11-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-6-yl]methyl acetate $$$$