Mrv1533004181500562D 17 19 0 0 0 0 999 V2000 1.8651 1.7897 0.0000 C 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 3.6659 -0.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1204 -0.8625 0.0000 O 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 5.5607 -1.1574 0.0000 O 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 5.6412 0.6356 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 2.3265 0.4710 0.0000 C 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 1.5912 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3864 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6763 -1.6349 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 3 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 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 5 10 1 0 0 0 0 10 11 2 0 0 0 0 6 12 1 0 0 0 0 12 13 1 0 0 0 0 2 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 12 16 1 0 0 0 0 16 17 2 0 0 0 0 M END > NP0251899 > NP-MRD > CC1=CCC2C(OC(=O)C2=C)C2C1CCC2=C > InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h4,11-14H,2-3,5-7H2,1H3 > BWRZDLYJNURUHS-UHFFFAOYSA-N > C15H18O2 > 230.307 > 230.13067982 > 1 > 35 > 25.977977554140654 > 1 > 0 > 0 > 1 > 6-methyl-3,9-dimethylidene-2H,3H,3aH,4H,6aH,7H,8H,9H,9aH,9bH-azuleno[4,5-b]furan-2-one > 3.43 > 3.017321547 > -3.06 > 0 > 3 > 0 > -6.866616846188646 > 26.3 > 67.0439 > 0 > 1 > 2.00e-01 g/l > 6-methyl-3,9-dimethylidene-3aH,4H,6aH,7H,8H,9aH,9bH-azuleno[4,5-b]furan-2-one > 1 > NP0251899 > 6-methyl-3,9-dimethylidene-3ah,4h,6ah,7h,8h,9ah,9bh-azuleno[4,5-b]furan-2-one $$$$