Marvin 07241214082D 85 90 0 0 1 0 999 V2000 17.8815 -4.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3776 -4.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2834 -5.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6296 -4.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5353 -5.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7238 -5.1683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9815 -4.7875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6796 -5.2317 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0757 -5.2317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2334 -4.7875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3276 -5.2317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4853 -4.7875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9315 -5.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8372 -4.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.0257 -4.7875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.1834 -5.1683 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.5796 -8.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8815 -8.8491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.5751 -5.2342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3776 -3.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7238 -5.9933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2834 -6.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5353 -5.9933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6296 -3.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8372 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0257 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5796 -7.6433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.2776 -8.8491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5353 -3.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9315 -2.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6796 -6.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2334 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5353 -2.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9315 -3.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2334 -2.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6296 -2.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3776 -6.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1834 -5.9933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7238 -3.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8815 -7.1991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8815 -6.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7238 -2.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4853 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5646 -4.8204 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5615 -3.9954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8517 -5.2356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2745 -3.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3576 -2.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0294 -3.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1639 -2.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5792 -3.2977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3726 -1.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7856 -1.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9901 -1.4253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7814 -2.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1357 -4.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1333 -4.0053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4177 -5.2379 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7043 -4.8235 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4177 -6.0629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1321 -6.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8858 -6.1398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2184 -7.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4379 -6.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0255 -7.4674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9887 -5.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2751 -4.8189 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9863 -6.0629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5203 -5.1518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1917 -3.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9703 -4.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 -3.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1496 -4.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8861 -3.9656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.5534 -3.4806 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.2185 -3.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2984 -2.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4734 -2.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2679 -3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2679 -4.7181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9824 -3.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6968 -3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4113 -3.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1258 -3.8931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.4113 -2.6556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16 1 1 0 0 0 0 19 1 2 0 0 0 0 9 2 1 0 0 0 0 8 2 1 0 0 0 0 20 2 2 0 0 0 0 7 3 1 0 0 0 0 22 3 2 0 0 0 0 11 4 1 0 0 0 0 13 4 1 0 0 0 0 24 4 2 0 0 0 0 10 5 1 0 0 0 0 14 5 1 0 0 0 0 23 5 2 0 0 0 0 12 6 1 0 0 0 0 15 6 1 0 0 0 0 21 6 2 0 0 0 0 8 7 1 0 0 0 0 8 31 1 6 0 0 0 14 9 1 0 0 0 0 13 10 1 0 0 0 0 15 11 1 0 0 0 0 16 12 1 0 0 0 0 14 25 1 1 0 0 0 15 26 1 1 0 0 0 16 38 1 6 0 0 0 27 17 1 0 0 0 0 18 17 2 0 0 0 0 28 17 1 0 0 0 0 29 25 1 0 0 0 0 39 26 1 0 0 0 0 40 27 1 0 0 0 0 32 29 1 0 0 0 0 33 29 2 0 0 0 0 34 30 1 0 0 0 0 36 30 1 0 0 0 0 35 30 2 0 0 0 0 37 31 1 0 0 0 0 34 32 2 0 0 0 0 35 33 1 0 0 0 0 41 38 1 0 0 0 0 42 39 1 0 0 0 0 43 39 1 0 0 0 0 41 40 1 0 0 0 0 3 44 1 0 0 0 0 44 45 1 1 0 0 0 44 46 1 0 0 0 0 48 47 1 0 0 0 0 49 47 2 0 0 0 0 51 49 1 0 0 0 0 51 50 1 0 0 0 0 45 47 1 0 0 0 0 50 52 1 0 0 0 0 53 52 2 0 0 0 0 48 50 2 0 0 0 0 54 53 1 0 0 0 0 55 48 1 0 0 0 0 55 54 2 0 0 0 0 46 56 1 0 0 0 0 56 57 2 0 0 0 0 56 58 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 6 0 0 0 62 61 1 0 0 0 0 63 61 2 0 0 0 0 64 62 2 0 0 0 0 65 63 1 0 0 0 0 65 64 1 0 0 0 0 60 61 1 0 0 0 0 59 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 2 0 0 0 0 69 67 1 0 0 0 0 67 70 1 1 0 0 0 71 69 1 0 0 0 0 72 70 1 0 0 0 0 72 71 1 0 0 0 0 71 73 2 0 0 0 0 1 74 1 0 0 0 0 75 74 1 0 0 0 0 76 74 1 0 0 0 0 77 75 1 0 0 0 0 78 76 1 0 0 0 0 78 77 1 0 0 0 0 80 79 2 0 0 0 0 81 79 1 0 0 0 0 81 82 1 0 0 0 0 82 83 1 0 0 0 0 75 79 1 1 0 0 0 83 84 1 0 0 0 0 83 85 2 0 0 0 0 M END > CHEBI:5520 > gonadorelin > A ten-membered synthetic oligopeptide comprising pyroglutamyl, histidyl, tryptophyl, seryl, tyrosyl, glycyl, leucyl, arginyl, prolyl and glycinamide residues joined in sequence. > 3 > p-Glu-His-Trp-Ser-Tyr-Gly-Leu-Arg-Pro-Gly-NH2; Luteinizing hormone-releasing factor; luliberin; LH-Releasing hormone; LH-Releasing factor; Gonadotropin-releasing hormone I; Gonadotropin-releasing factor; Gonadorelin; Gonadoliberin I; GnRH-I; Follicle-stimulating hormone-releasing factor; 5-oxo-PHWSYGLRPGNH2 > 5-oxo-L-prolyl-L-histidyl-L-tryptophyl-L-seryl-L-tyrosylglycyl-L-leucyl-L-arginyl-L-prolylglycinamide > gonadorelinum; gonadorelina; gonadorelin > C55H75N17O13 > 1182.29010 > 1181.57303 > 0 > CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O > InChI=1S/C55H75N17O13/c1-29(2)19-38(49(80)67-37(9-5-17-60-55(57)58)54(85)72-18-6-10-43(72)53(84)62-25-44(56)75)66-46(77)26-63-47(78)39(20-30-11-13-33(74)14-12-30)68-52(83)42(27-73)71-50(81)40(21-31-23-61-35-8-4-3-7-34(31)35)69-51(82)41(22-32-24-59-28-64-32)70-48(79)36-15-16-45(76)65-36/h3-4,7-8,11-14,23-24,28-29,36-43,61,73-74H,5-6,9-10,15-22,25-27H2,1-2H3,(H2,56,75)(H,59,64)(H,62,84)(H,63,78)(H,65,76)(H,66,77)(H,67,80)(H,68,83)(H,69,82)(H,70,79)(H,71,81)(H4,57,58,60)/t36-,37-,38-,39-,40-,41-,42-,43-/m0/s1 > XLXSAKCOAKORKW-AQJXLSMYSA-N > 33515-09-2 > 741807 > 33515-09-2 > DB00644 > C07607 > D08027 > Gonadorelin > 21872303; 22112812; 22214466; 22289217; 22504307; 22761896 $$$$