Mrv1533004171503302D 31 35 0 0 0 0 999 V2000 5.4731 -0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7651 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4709 -1.1378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3052 0.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0352 1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2251 1.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 0.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4149 1.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8748 0.7243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3347 0.1007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 -0.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4149 -0.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -0.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0647 -1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3347 -2.0821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2546 -1.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9845 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1744 -0.2111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0957 0.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4444 1.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2546 1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7946 1.6598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5246 0.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9058 0.7243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4459 0.1007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 0.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5261 1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3362 1.1921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 1.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 2.4393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1758 1.5039 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 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 1 0 0 0 0 7 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 12 13 1 0 0 0 0 2 13 1 0 0 0 0 7 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 10 23 1 0 0 0 0 17 23 2 0 0 0 0 19 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 24 31 1 0 0 0 0 M END > NP0190931 > NP-MRD > CC1(C)CCCC2(C)OC3=C(CC12)C(O)=CC1=C3C(=O)C=C(O1)C1=CC=C(O)C(O)=C1 > InChI=1S/C25H26O6/c1-24(2)7-4-8-25(3)21(24)10-14-16(27)11-20-22(23(14)31-25)18(29)12-19(30-20)13-5-6-15(26)17(28)9-13/h5-6,9,11-12,21,26-28H,4,7-8,10H2,1-3H3 > AWGPELCDBUFEAW-UHFFFAOYSA-N > C25H26O6 > 422.477 > 422.172938557 > 6 > 57 > 46.20825688614674 > 1 > 3 > 0 > 1 > 2-(3,4-dihydroxyphenyl)-11-hydroxy-5a,9,9-trimethyl-4,5a,6,7,8,9,9a,10-octahydro-1,5-dioxatetraphen-4-one > 5.21 > 4.5360309323333325 > -4.97 > 0 > 5 > -1 > 8.709369112044204 > 6.839352803818455 > -4.80644152385216 > 96.22 > 117.16279999999998 > 1 > 1 > 4.49e-03 g/l > ugonin S > 0 > NP0190931 > ugonin s $$$$