Marvin 10181209222D 32 35 0 0 0 0 999 V2000 -3.3650 -17.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7737 -16.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1869 -17.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4826 -15.7161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4826 -16.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -15.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0574 -15.7161 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0564 -16.5417 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3448 -16.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6297 -16.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3469 -15.3001 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6328 -15.7126 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9224 -15.3027 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9199 -14.4786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -14.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3507 -14.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0648 -14.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0606 -17.3631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3518 -16.1247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9215 -16.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2081 -15.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5076 -15.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -14.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2204 -15.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9357 -15.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9375 -14.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2181 -14.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5059 -14.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2165 -13.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9308 -12.8291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5008 -12.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2181 -16.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 7 17 1 1 0 0 0 2 1 1 0 0 0 0 8 18 1 6 0 0 0 3 2 1 0 0 0 0 11 19 1 6 0 0 0 7 11 1 0 0 0 0 12 20 1 1 0 0 0 8 9 1 0 0 0 0 13 21 1 1 0 0 0 9 10 1 0 0 0 0 21 22 1 0 0 0 0 10 12 1 0 0 0 0 14 23 1 0 0 0 0 11 12 1 0 0 0 0 22 24 2 0 0 0 0 4 6 1 0 0 0 0 24 25 1 0 0 0 0 5 2 1 0 0 0 0 25 26 2 0 0 0 0 2 8 1 0 0 0 0 26 27 1 0 0 0 0 7 6 1 0 0 0 0 27 28 2 0 0 0 0 28 22 1 0 0 0 0 7 8 1 0 0 0 0 27 29 1 0 0 0 0 4 5 1 0 0 0 0 29 30 1 0 0 0 0 11 16 1 0 0 0 0 29 31 2 0 0 0 0 12 13 1 0 0 0 0 24 32 1 0 0 0 0 M END > CHEBI:66654 > (+)-makassaric acid > A meroterpenoid isolated from the marine sponge Acanthodendrilla sp. It exhibits inhibitory activity against the enzyme mitogen-activated protein kinase-activated protein kinase 2 (EC 2.7.11.1). > 3 > 4-hydroxy-3-{[(1R,4aR,4bS,8aS,10aS)-2,4b,8,8,10a-pentamethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]methyl}benzoic acid > 3-{[(14beta)-8,13-dimethylpodocarp-12-en-14-yl]methyl}-4-hydroxybenzoic acid > C27H38O3 > 410.58880 > 410.28210 > 0 > [H][C@@]12CC[C@@]3(C)[C@H](Cc4cc(ccc4O)C(O)=O)C(C)=CC[C@]3([H])[C@@]1(C)CCCC2(C)C > InChI=1S/C27H38O3/c1-17-7-10-23-26(4,14-11-22-25(2,3)12-6-13-27(22,23)5)20(17)16-19-15-18(24(29)30)8-9-21(19)28/h7-9,15,20,22-23,28H,6,10-14,16H2,1-5H3,(H,29,30)/t20-,22+,23+,26+,27+/m1/s1 > VIOMEESUKISOEL-XDEZJFBHSA-N > 11308967 > 15620270 $$$$