Marvin 05021311402D 44 46 0 0 1 0 999 V2000 8.4501 -3.7646 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 -4.5896 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -4.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -3.7646 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1645 -3.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7356 -5.8270 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4501 -6.3220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -6.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5935 -5.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5935 -5.0020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 -7.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1646 -7.4770 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8790 -7.0645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1757 -5.8334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1757 -4.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6083 -3.3521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3228 -3.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0372 -3.3521 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.7516 -3.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 -3.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1928 -3.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9074 -3.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9075 -2.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1809 -2.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4663 -2.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0372 -2.5271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3228 -4.4657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5771 -2.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7521 -2.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0312 -6.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3315 -5.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0311 -7.0644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7356 -7.4770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6393 -2.1120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1646 -8.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4402 -8.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7308 -8.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0163 -8.7230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0163 -9.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7257 -9.9577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4402 -9.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3232 -4.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9107 -5.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7356 -5.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 1 5 1 0 0 0 0 2 44 1 0 0 0 0 44 6 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 3 10 1 0 0 0 0 7 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 8 1 0 0 0 0 8 14 2 0 0 0 0 3 15 2 0 0 0 0 4 16 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 20 25 1 0 0 0 0 18 26 1 1 0 0 0 17 27 2 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 1 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 11 33 2 0 0 0 0 23 34 1 0 0 0 0 12 35 1 1 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 36 41 1 0 0 0 0 43 44 1 0 0 0 0 44 42 1 0 0 0 0 M END > CHEBI:73356 > DPDPE > A heterodetic cyclic peptide that is a cyclic enkephalin analogue, having D-penicillaminyl residues located at positions 2 and 5, which form the heterocycle via a disulfide bond. > 3 > L-tyrosyl-3-mercapto-D-valylglycyl-L-phenylalanyl-3-mercapto-D-valine, cyclic (2-5)-disulfide; H-Tyr-cyclo-(D-Pen-Gly-Phe-D-Pen)-OH; H-Tyr-c(D-Pen-Gly-Phe-D-Pen)-OH; D-penicillamine-(2,5)-enkephalin; cyclo-[D-Pen(2,5)]-enkephalin; c[D-Pen(2,5)]-enkephalin; [D-Pen(2)-D-Pen(5)]-enkephaline; 2,5-Pen-enkephalin; (D-Pen2,D-Pen5)-Enkephalin > (4S,7S,13S)-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-13-(L-tyrosylamino)-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid > C30H39N5O7S2 > 645.79000 > 645.22909 > 0 > CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H]1C(O)=O > InChI=1S/C30H39N5O7S2/c1-29(2)23(34-25(38)20(31)14-18-10-12-19(36)13-11-18)27(40)32-16-22(37)33-21(15-17-8-6-5-7-9-17)26(39)35-24(28(41)42)30(3,4)44-43-29/h5-13,20-21,23-24,36H,14-16,31H2,1-4H3,(H,32,40)(H,33,37)(H,34,38)(H,35,39)(H,41,42)/t20-,21-,23-,24-/m0/s1 > MCMMCRYPQBNCPH-WMIMKTLMSA-N > 88373-73-3 > 3586429 > 88373-73-3 > C20164 > 22995282; 23203254; 23564013; 23597562 $$$$