Mrv1533004171521382D 21 23 0 0 0 0 999 V2000 1.3431 3.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9881 2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 2.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8651 1.7897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5101 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2534 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9967 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1803 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9527 0.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9157 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1204 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8305 -1.6349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6659 -0.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8409 -0.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3864 -0.8625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5912 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9461 -1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5541 0.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8656 0.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3265 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6417 1.7897 0.0000 C 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 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 8 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 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 5 20 1 0 0 0 0 14 20 1 0 0 0 0 7 21 1 0 0 0 0 M END > NP0236273 > NP-MRD > CC(=O)OC1CC(C)=C2CC=C(C)C2C2OC(=O)C(=C)C12 > InChI=1S/C17H20O4/c1-8-5-6-12-9(2)7-13(20-11(4)18)15-10(3)17(19)21-16(15)14(8)12/h5,13-16H,3,6-7H2,1-2,4H3 > YSIJTYIIZIQCSP-UHFFFAOYSA-N > C17H20O4 > 288.343 > 288.136159124 > 2 > 41 > 30.558832496122466 > 1 > 0 > 0 > 1 > 6,9-dimethyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,7H,9aH,9bH-azuleno[4,5-b]furan-4-yl acetate > 2.96 > 2.0116936623333337 > -3.06 > 0 > 3 > 0 > 19.902020097553617 > -6.632773893397412 > 52.6 > 78.572 > 2 > 1 > 2.53e-01 g/l > 6,9-dimethyl-3-methylidene-2-oxo-3aH,4H,5H,7H,9aH,9bH-azuleno[4,5-b]furan-4-yl acetate > 0 > NP0236273 > 6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate $$$$