Mrv1533004161513082D 19 21 0 0 0 0 999 V2000 2.5024 -0.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3148 1.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 0.5547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 0.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3984 0.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2054 -0.1006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6284 1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4534 1.5229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 2.1904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5072 2.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8946 1.9642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2819 2.6927 0.0000 C 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 2 4 1 0 0 0 0 2 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 8 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 7 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 5 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 M END > NP0330148 > NP-MRD > CC1(CO1)C1CC2=C(CO)C(=O)OC2CC1(C)C=C > InChI=1S/C15H20O4/c1-4-14(2)6-11-9(10(7-16)13(17)19-11)5-12(14)15(3)8-18-15/h4,11-12,16H,1,5-8H2,2-3H3 > SZCVYRMBUHRYRY-UHFFFAOYSA-N > C15H20O4 > 264.321 > 264.136159124 > 3 > 39 > 27.80765019491197 > 1 > 1 > 0 > 1 > 6-ethenyl-3-(hydroxymethyl)-6-methyl-5-(2-methyloxiran-2-yl)-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-one > 1.55 > 1.2825827783333332 > -2.42 > 0 > 3 > 0 > 14.965937261939978 > 13.034096271803683 > -2.859347317116682 > 59.06 > 70.5625 > 3 > 1 > 1.02e+00 g/l > 6-ethenyl-3-(hydroxymethyl)-6-methyl-5-(2-methyloxiran-2-yl)-4,5,7,7a-tetrahydro-1-benzofuran-2-one > 0 > NP0330148 > 6-ethenyl-3-(hydroxymethyl)-6-methyl-5-(2-methyloxiran-2-yl)-4,5,7,7a-tetrahydro-1-benzofuran-2-one $$$$