Mrv1652306192119063D 43 45 0 0 0 0 999 V2000 -1.7788 -1.4815 -0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4747 -2.2053 0.2738 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5854 -3.6860 -0.1189 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6222 -4.4747 0.3845 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6406 -5.7462 -0.2533 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9203 -3.7912 0.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0365 -2.4947 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3806 -1.9307 -0.6507 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7188 -0.6491 0.0875 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5739 0.3621 0.1186 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8837 1.3266 1.1457 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8662 1.2748 2.1413 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9715 2.3600 1.8993 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1015 -0.0573 1.9566 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7251 -1.1569 2.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2593 0.0948 2.3854 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1769 -0.2032 0.4256 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8341 -1.5404 -0.3115 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6120 -1.2138 -1.8196 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0374 -1.6081 -1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 -0.4112 0.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6107 -1.8897 0.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4217 -2.1979 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4963 -4.1299 0.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 -3.7938 -1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5424 -4.6469 1.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7758 -5.5860 -1.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -4.4225 0.1505 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3856 -1.7429 -1.7306 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1833 -2.6579 -0.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0634 -0.8837 1.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5922 -0.1783 -0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5531 0.8982 -0.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2955 1.3945 3.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5153 3.1525 2.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7966 -1.2780 2.6602 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5794 -0.9244 3.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2456 -2.1262 2.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4838 1.0302 2.1927 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4551 0.5341 0.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3789 -2.1143 -2.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4898 -0.7523 -2.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2074 -0.5017 -1.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 10 17 1 0 0 0 0 2 18 1 0 0 0 0 7 6 2 0 0 0 0 7 18 1 0 0 0 0 4 3 1 0 0 0 0 17 14 1 0 0 0 0 14 12 1 0 0 0 0 12 11 1 0 0 0 0 4 6 1 0 0 0 0 14 15 1 0 0 0 0 3 2 1 0 0 0 0 18 19 1 6 0 0 0 7 8 1 0 0 0 0 2 1 1 0 0 0 0 18 17 1 0 0 0 0 4 5 1 0 0 0 0 10 9 1 0 0 0 0 12 13 1 0 0 0 0 9 8 1 0 0 0 0 14 16 1 1 0 0 0 10 11 1 0 0 0 0 4 26 1 1 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 2 23 1 1 0 0 0 6 28 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 10 33 1 6 0 0 0 17 40 1 6 0 0 0 12 34 1 1 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 5 27 1 0 0 0 0 13 35 1 0 0 0 0 16 39 1 0 0 0 0 M END > NP0024821 > NP-MRD > [H]O[C@]1([H])O[C@@]2([H])C([H])([H])C([H])([H])C3=C([H])[C@]([H])(O[H])C([H])([H])[C@]([H])(C([H])([H])[H])[C@@]3(C([H])([H])[H])[C@@]2([H])[C@@]1(O[H])C([H])([H])[H] > InChI=1S/C15H24O4/c1-8-6-10(16)7-9-4-5-11-12(14(8,9)2)15(3,18)13(17)19-11/h7-8,10-13,16-18H,4-6H2,1-3H3/t8-,10+,11-,12-,13+,14+,15-/m0/s1 > FSKATUVMXYAJEV-POZTZHBISA-N > C15H24O4 > 268.353 > 268.167459253 > 4 > 43 > 28.734756611858984 > 1 > 3 > 0 > 1 > (1S,2R,3aS,7R,9S,9aS,9bR)-1,9,9a-trimethyl-1H,2H,3aH,4H,5H,7H,8H,9H,9aH,9bH-naphtho[2,1-b]furan-1,2,7-triol > 0.82 > 0.6483910446666658 > -1.62 > 0 > 3 > 0 > 13.817015525250415 > 11.246490126245474 > -1.5625963435113785 > 69.92 > 71.5837 > 0 > 1 > 6.41e+00 g/l > (1S,2R,3aS,7R,9S,9aS,9bR)-1,9,9a-trimethyl-2H,3aH,4H,5H,7H,8H,9H,9bH-naphtho[2,1-b]furan-1,2,7-triol > 0 > NP0024821 > elongatol D $$$$