Mrv0541 10281313492D 40 44 0 0 0 0 999 V2000 1.3402 -1.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1228 -2.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7621 -1.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3276 -2.8779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0329 -1.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2502 -2.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1611 -1.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4512 -2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8096 -3.1126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 -1.1047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4528 -1.0389 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2555 -0.6970 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5237 -1.8307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7684 -1.3447 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3163 -2.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6057 -2.8238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3676 0.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5809 -1.2128 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8807 -0.4333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0922 -2.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2327 -0.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9699 -0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7575 -1.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5729 -0.8217 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3910 -0.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0243 -1.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9063 -2.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9073 -2.8072 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1168 -3.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5267 -2.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5172 -1.8496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5048 -1.9211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -2.5921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6009 -0.3107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4972 -3.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0311 0.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6681 0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9174 -3.8487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 -0.3089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 7 1 1 0 0 0 0 2 1 1 0 0 0 0 8 7 2 0 0 0 0 9 2 1 0 0 0 0 9 8 1 0 0 0 0 7 10 1 0 0 0 0 12 11 1 0 0 0 0 13 11 1 0 0 0 0 15 13 1 0 0 0 0 15 14 1 0 0 0 0 11 10 1 1 0 0 0 15 16 2 0 0 0 0 17 12 1 0 0 0 0 14 12 1 0 0 0 0 19 14 1 0 0 0 0 20 19 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 6 0 0 0 25 27 1 0 0 0 0 21 28 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 12 35 1 1 0 0 0 14 33 1 1 0 0 0 19 24 1 6 0 0 0 29 36 1 1 0 0 0 21 27 2 0 0 0 0 29 21 1 0 0 0 0 31 32 2 0 0 0 0 17 37 1 0 0 0 0 17 18 2 0 0 0 0 18 38 1 0 0 0 0 30 39 2 0 0 0 0 20 40 1 1 0 0 0 20 18 1 0 0 0 0 M END > CHEBI:68734 > chaetoglobosin B > A natural product found in Chaetomium globosum and Chaetomium subaffine. > 3 > (3S,3aR,6S,6aR,7E,10S,11E,13R,15E,17aR)-6,13-dihydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-2,3,3a,6,6a,9,10,13-octahydro-1H-cyclotrideca[d]isoindole-1,14,17-trione > C32H36N2O5 > 528.63860 > 528.26242 > 0 > C[C@H]1C\C=C\[C@H]2[C@H](O)C(C)=C(C)[C@H]3[C@H](Cc4c[nH]c5ccccc45)NC(=O)[C@@]23C(=O)\C=C\C(=O)[C@H](O)\C(C)=C\1 > InChI=1S/C32H36N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25,28-30,33,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14+/t17-,23-,25-,28-,29+,30+,32+/m0/s1 > VUEFRYQBOMQOMV-MLXGBZTESA-N > 5787084 > 15497948 $$$$