CDK 1018121543 36 41 0 0 0 0 0 0 0 0999 V2000 18.7542 -2.0601 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.0842 -1.5785 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.4702 -1.6455 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.4987 -2.8472 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.0339 -0.8291 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.4744 -2.5291 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.4143 -2.0601 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.4659 -0.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7499 -0.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3222 -0.4229 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.6739 -2.8472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6104 -0.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3222 0.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6145 -1.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3342 -2.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0339 0.8207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.1904 -2.9394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3299 -1.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1172 -2.7803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1130 -1.4488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6029 -2.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6182 -2.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9022 -2.5248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6062 0.8123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6098 -1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9022 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0298 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7458 2.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7458 2.8808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4618 1.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0339 -0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9502 -2.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2615 -1.4320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9049 -3.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8239 -2.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7584 -1.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 5 2 1 0 0 0 0 6 4 1 0 0 0 0 7 2 1 0 0 0 0 8 3 1 0 0 0 0 9 5 1 0 0 0 0 10 5 1 0 0 0 0 11 4 1 0 0 0 0 12 14 2 0 0 0 0 10 13 1 1 0 0 0 14 7 1 0 0 0 0 15 22 1 0 0 0 0 16 13 1 0 0 0 0 6 17 1 1 0 0 0 18 15 2 0 0 0 0 19 15 1 0 0 0 0 20 18 1 0 0 0 0 21 19 1 0 0 0 0 22 23 2 0 0 0 0 23 17 1 0 0 0 0 24 13 2 0 0 0 0 25 26 2 0 0 0 0 26 23 1 0 0 0 0 27 16 1 0 0 0 0 28 27 1 0 0 0 0 29 28 1 0 0 0 0 30 28 1 0 0 0 0 5 31 1 1 0 0 0 1 32 1 1 0 0 0 3 33 1 1 0 0 0 4 34 1 1 0 0 0 7 35 1 6 0 0 0 2 36 1 1 0 0 0 6 3 1 0 0 0 0 11 7 1 0 0 0 0 9 8 2 0 0 0 0 12 10 1 0 0 0 0 25 18 1 0 0 0 0 20 21 1 0 0 0 0 M END > CHEBI:69315 > endiandramide A > A natural product found in Beilschmiedia tsangii. > 2 > (1S,1aS,2aS,5R,5aR,7aR,7bS,7cS)-1-(1,3-Benzodioxol-5-ylmethyl)-N-isobutyl-1a,2,2a,5,5a,7a,7b,7c-octahydro-1H-cyclobuta[bc]acenaphthylene-5-carboxamide > C26H31NO3 > 405.52920 > 405.23039 > 0 > [H][C@]12C[C@@]3([H])[C@H](Cc4ccc5OCOc5c4)[C@@]4([H])C=C[C@@]([H])([C@@H](C=C1)C(=O)NCC(C)C)[C@]2([H])[C@@]34[H] > InChI=1S/C26H31NO3/c1-14(2)12-27-26(28)19-5-4-16-11-21-20(18-7-6-17(19)24(16)25(18)21)9-15-3-8-22-23(10-15)30-13-29-22/h3-8,10,14,16-21,24-25H,9,11-13H2,1-2H3,(H,27,28)/t16-,17+,18-,19-,20-,21+,24-,25-/m1/s1 > VJYDYOYYSFAXSI-DLGBIPEUSA-N > 21846089 $$$$