Mrv1652309082208172D 23 24 0 0 1 0 999 V2000 1.7179 -4.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7179 -3.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0034 -3.0882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4324 -3.0882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1468 -3.5007 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8613 -3.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8613 -2.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5758 -1.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5758 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2903 -2.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1468 -4.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8143 -4.8107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5593 -5.5953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7343 -5.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2494 -6.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -7.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1001 -7.6838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4356 -8.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2796 -7.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -6.8439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -6.1765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0934 -5.4228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4794 -4.8107 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 5 4 1 1 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 8 10 1 0 0 0 0 5 11 1 0 0 0 0 11 12 2 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 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 14 23 2 0 0 0 0 11 23 1 0 0 0 0 M END > NP0263194 > NP-MRD > CC(C)=CC[C@H](OC(C)=O)C1=COC(=C1)C1=CC(O)=CC=C1O > InChI=1S/C18H20O5/c1-11(2)4-7-17(23-12(3)19)13-8-18(22-10-13)15-9-14(20)5-6-16(15)21/h4-6,8-10,17,20-21H,7H2,1-3H3/t17-/m0/s1 > IMZVJDUASUPZQK-KRWDZBQOSA-N > C18H20O5 > 316.353 > 316.131073744 > 3 > 43 > 33.6469244218964 > 1 > 2 > 0 > 1 > (1S)-1-[5-(2,5-dihydroxyphenyl)furan-3-yl]-4-methylpent-3-en-1-yl acetate > 3.4570371863333333 > 0 > 2 > 0 > 10.915059621659287 > 8.900603647784415 > -2.9221423330632326 > 79.9 > 87.0577 > 6 > 1 > (1S)-1-[5-(2,5-dihydroxyphenyl)furan-3-yl]-4-methylpent-3-en-1-yl acetate > 0 > NP0263194 > (1s)-1-[5-(2,5-dihydroxyphenyl)furan-3-yl]-4-methylpent-3-en-1-yl acetate $$$$