CDK 9/10/12,15:49 65 68 0 0 0 0 0 0 0 0999 V2000 12.4666 -1.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9803 0.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9512 -1.2388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2819 -3.0761 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2694 -3.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0800 -2.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3835 -0.4906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1406 0.5196 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3269 0.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3269 0.1122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4962 -4.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1650 -0.7400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5913 -3.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9587 -0.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7813 -3.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2191 -1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0219 -4.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9202 1.3219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2920 1.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6119 1.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3468 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 1.3510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8613 -1.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6560 1.7293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0247 -4.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9587 -1.1805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6402 0.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6030 -1.6420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0619 0.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4965 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -2.1408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 0.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9052 0.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0806 1.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9182 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3263 -3.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9647 -0.3575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3614 1.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8655 -0.6277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2073 0.9478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8150 1.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7685 1.3510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0619 0.1205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 0.9478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4835 0.9395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3263 -2.8974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9883 -2.1325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6030 -2.4817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1902 1.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0748 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4630 -5.0714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9707 -4.9384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9052 0.1122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8353 -2.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5508 1.5547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3468 2.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9754 2.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2073 0.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0371 -2.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1902 2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1780 -5.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1902 -0.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0748 2.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9103 0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6658 -0.0755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 1 1 0 0 0 0 4 6 2 0 0 0 0 5 4 1 0 0 0 0 6 1 1 0 0 0 0 7 3 2 0 0 0 0 8 2 1 0 0 0 0 9 22 1 0 0 0 0 10 9 1 0 0 0 0 11 5 1 0 0 0 0 12 16 1 0 0 0 0 13 6 1 0 0 0 0 14 26 1 0 0 0 0 15 11 1 0 0 0 0 16 1 2 0 0 0 0 17 13 1 0 0 0 0 18 8 2 0 0 0 0 19 2 2 0 0 0 0 9 20 1 1 0 0 0 21 29 1 0 0 0 0 22 41 1 0 0 0 0 23 31 1 0 0 0 0 24 19 1 0 0 0 0 25 15 1 0 0 0 0 26 28 1 0 0 0 0 27 21 2 0 0 0 0 28 48 1 0 0 0 0 29 42 1 0 0 0 0 30 32 2 0 0 0 0 28 31 1 1 0 0 0 32 50 1 0 0 0 0 33 20 1 0 0 0 0 34 18 1 0 0 0 0 35 40 1 0 0 0 0 36 25 1 0 0 0 0 37 14 2 0 0 0 0 38 34 2 0 0 0 0 39 23 2 0 0 0 0 40 30 1 0 0 0 0 41 55 1 0 0 0 0 42 45 1 0 0 0 0 43 29 2 0 0 0 0 44 35 2 0 0 0 0 45 49 1 0 0 0 0 46 36 1 0 0 0 0 47 23 1 0 0 0 0 48 46 1 0 0 0 0 49 33 1 0 0 0 0 50 27 1 0 0 0 0 11 51 1 6 0 0 0 25 52 1 1 0 0 0 33 53 1 6 0 0 0 15 54 1 6 0 0 0 55 38 1 0 0 0 0 56 21 1 0 0 0 0 22 57 1 6 0 0 0 58 40 1 0 0 0 0 46 59 1 6 0 0 0 49 60 1 6 0 0 0 61 51 1 0 0 0 0 62 53 1 0 0 0 0 50 63 1 1 0 0 0 7 12 1 0 0 0 0 17 5 2 0 0 0 0 18 24 1 0 0 0 0 10 14 1 0 0 0 0 41 64 1 6 0 0 0 2 7 1 0 0 0 0 64 65 1 0 0 0 0 M END > CHEBI:68059 > kabiramide G > A natural product found in Pachastrissa nux. > 2 > C47H67N5O13 > 910.06060 > 909.47354 > 0 > CO[C@@H](C[C@@H]1OC(=O)C[C@H](C[C@H](C)C[C@H](O)[C@H](C)[C@@H](OC)c2coc(n2)-c2coc(n2)-c2coc(\C=C\C[C@H](OC)[C@H]1C)n2)OC(N)=O)[C@@H](C)CCC(=O)C(\C)=C\[C@H](C)\C=C\N(C)C=O > InChI=1S/C47H67N5O13/c1-27(16-17-52(7)26-53)18-30(4)37(54)15-14-29(3)40(59-9)22-41-32(6)39(58-8)12-11-13-42-49-35(24-61-42)45-51-36(25-63-45)46-50-34(23-62-46)44(60-10)31(5)38(55)20-28(2)19-33(64-47(48)57)21-43(56)65-41/h11,13,16-18,23-29,31-33,38-41,44,55H,12,14-15,19-22H2,1-10H3,(H2,48,57)/b13-11+,17-16+,30-18+/t27-,28+,29+,31+,32-,33+,38+,39+,40+,41+,44-/m1/s1 > FBMVXDQBPTYEAM-RUWUMMDESA-N > 21410162 $$$$