Marvin 04301316342D 34 33 0 0 1 0 999 V2000 8.2541 -8.9523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2541 -9.7772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5396 -8.5398 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9686 -8.5398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8252 -8.9523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5396 -7.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 -8.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 -7.7148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6831 -8.9523 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1119 -8.9523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6831 -9.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8252 -7.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8252 -6.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1106 -7.7148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 -10.1898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 -11.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1119 -9.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8265 -7.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 -8.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8265 -8.5397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.2554 -8.5397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 -9.7772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 -7.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2554 -7.7147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 -6.4772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6829 -8.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6732 -11.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6687 -7.7108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9709 -8.9564 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.3894 -11.4372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9653 -9.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6730 -10.2030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9610 -11.4437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4155 -8.9175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 3 5 1 1 0 0 0 6 3 1 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 10 7 1 0 0 0 0 9 4 1 6 0 0 0 9 11 1 0 0 0 0 12 6 1 0 0 0 0 13 12 2 0 0 0 0 14 12 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 20 18 1 0 0 0 0 20 19 1 0 0 0 0 21 19 1 0 0 0 0 22 19 2 0 0 0 0 20 10 1 1 0 0 0 18 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 28 26 2 0 0 0 0 29 26 1 0 0 0 0 34 26 1 0 0 0 0 32 27 1 0 0 0 0 30 27 2 0 0 0 0 33 27 1 0 0 0 0 31 29 1 0 0 0 0 29 21 1 6 0 0 0 32 31 1 0 0 0 0 M END > CHEBI:73428 > Asp-Leu-Asp-Gln > A tetrapeptide composed of L-aspartic acid, L-leucine, L-aspartic acid, and L-glutamine joined in sequence by peptide linkages. > 3 > L-Asp-L-Leu-L-Asp-L-Gln; DLDQ; D-L-D-Q > L-alpha-aspartyl-L-leucyl-L-alpha-aspartyl-L-glutamine > C19H31N5O10 > 489.47690 > 489.20709 > 0 > CC(C)C[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(O)=O > InChI=1S/C19H31N5O10/c1-8(2)5-11(23-16(30)9(20)6-14(26)27)17(31)24-12(7-15(28)29)18(32)22-10(19(33)34)3-4-13(21)25/h8-12H,3-7,20H2,1-2H3,(H2,21,25)(H,22,32)(H,23,30)(H,24,31)(H,26,27)(H,28,29)(H,33,34)/t9-,10-,11-,12-/m0/s1 > CMBDUPIBCOEWNE-BJDJZHNGSA-N $$$$