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0 0 0 169186 1 0 0 0 0 169187 1 0 0 0 0 169362 1 0 0 0 0 170176 1 0 0 0 0 170182 1 0 0 0 0 170364 1 0 0 0 0 171365 1 0 0 0 0 172369 1 0 0 0 0 172370 1 0 0 0 0 172371 1 0 0 0 0 173366 1 0 0 0 0 173367 1 0 0 0 0 173368 1 0 0 0 0 174175 1 0 0 0 0 174183 1 0 0 0 0 174372 1 0 0 0 0 176179 1 0 0 0 0 176373 1 0 0 0 0 176374 1 0 0 0 0 177178 1 0 0 0 0 177190 1 0 0 0 0 177375 1 0 0 0 0 178180 1 0 0 0 0 178376 1 0 0 0 0 178377 1 0 0 0 0 179184 1 0 0 0 0 179378 1 0 0 0 0 179379 1 0 0 0 0 180194 1 0 0 0 0 180195 1 0 0 0 0 180381 1 0 0 0 0 183196 1 0 0 0 0 183383 1 0 0 0 0 183384 1 0 0 0 0 184189 1 0 0 0 0 184385 1 0 0 0 0 184386 1 0 0 0 0 185387 1 0 0 0 0 186389 1 0 0 0 0 186390 1 0 0 0 0 186391 1 0 0 0 0 187392 1 0 0 0 0 187393 1 0 0 0 0 187394 1 0 0 0 0 188191 1 0 0 0 0 188201 1 0 0 0 0 188396 1 0 0 0 0 189203 1 0 0 0 0 189397 1 0 0 0 0 189398 1 0 0 0 0 192198 1 0 0 0 0 192204 1 0 0 0 0 192400 1 0 0 0 0 193197 1 0 0 0 0 193206 1 0 0 0 0 193399 1 0 0 0 0 194404 1 0 0 0 0 194405 1 0 0 0 0 194406 1 0 0 0 0 195401 1 0 0 0 0 195402 1 0 0 0 0 195403 1 0 0 0 0 196222 1 0 0 0 0 196407 1 0 0 0 0 196408 1 0 0 0 0 197200 1 0 0 0 0 197409 1 0 0 0 0 197410 1 0 0 0 0 199202 1 0 0 0 0 199205 1 0 0 0 0 199411 1 0 0 0 0 200216 1 0 0 0 0 200217 1 0 0 0 0 200412 1 0 0 0 0 201218 1 0 0 0 0 201413 1 0 0 0 0 202208 1 0 0 0 0 202414 1 0 0 0 0 202415 1 0 0 0 0 203223 1 0 0 0 0 203416 1 0 0 0 0 203417 1 0 0 0 0 204219 1 0 0 0 0 204418 1 0 0 0 0 204419 1 0 0 0 0 207213 1 0 0 0 0 207225 1 0 0 0 0 207425 1 0 0 0 0 208221 1 0 0 0 0 208423 1 0 0 0 0 208424 1 0 0 0 0 209215 1 0 0 0 0 209427 1 0 0 0 0 209428 1 0 0 0 0 210212 1 0 0 0 0 210224 1 0 0 0 0 210430 1 0 0 0 0 211214 1 0 0 0 0 211226 1 0 0 0 0 211431 1 0 0 0 0 212220 1 0 0 0 0 212432 1 0 0 0 0 212433 1 0 0 0 0 216438 1 0 0 0 0 216439 1 0 0 0 0 216440 1 0 0 0 0 217435 1 0 0 0 0 217436 1 0 0 0 0 217437 1 0 0 0 0 218441 1 0 0 0 0 218442 1 0 0 0 0 218443 1 0 0 0 0 219232 1 0 0 0 0 219445 1 0 0 0 0 219446 1 0 0 0 0 220228 1 0 0 0 0 220229 1 0 0 0 0 220444 1 0 0 0 0 221227 1 0 0 0 0 221447 1 0 0 0 0 221448 1 0 0 0 0 225450 1 0 0 0 0 225451 1 0 0 0 0 226453 1 0 0 0 0 226454 1 0 0 0 0 227456 1 0 0 0 0 227457 1 0 0 0 0 228458 1 0 0 0 0 228459 1 0 0 0 0 228460 1 0 0 0 0 229461 1 0 0 0 0 229462 1 0 0 0 0 229463 1 0 0 0 0 230231 1 0 0 0 0 230235 1 0 0 0 0 230464 1 0 0 0 0 233234 1 0 0 0 0 233465 1 0 0 0 0 233466 1 0 0 0 0 234236 1 0 0 0 0 234467 1 0 0 0 0 235237 1 0 0 0 0 235468 1 0 0 0 0 235469 1 0 0 0 0 M END > DB13742 > drugbank > [H]OC(=O)C([H])([H])C([H])([H])C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])([H])N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C1([H])N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])C(=O)C([H])(N([H])[H])C([H])([H])OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H])C([H])([H])C(=O)N([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])O[H])C([H])(O[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])O[H])C([H])([H])C([H])([H])C(=O)N([H])[H])C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N1C([H])([H])C([H])([H])C([H])([H])C1([H])C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])(C(=O)N([H])C([H])([H])C(=O)N([H])C([H])(C(=O)N([H])C([H])([H])C(=O)N([H])C([H])(C(=O)N1C([H])([H])C([H])([H])C([H])([H])C1([H])C(=O)N([H])[H])C([H])(O[H])C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C(=O)O[H])C([H])(O[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])N([H])C(=N[H])N([H])[H])C([H])([H])C1=C([H])C([H])=C(O[H])C([H])=C1[H])C([H])(O[H])C([H])([H])[H])C([H])([H])C([H])([H])C(=O)N([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])[H])C([H])([H])C1=C([H])N=C([H])N1[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H] > InChI=1S/C148H244N42O47/c1-69(2)52-92(178-142(231)115(75(13)14)185-128(217)87-30-21-20-22-36-113(208)237-67-84(151)122(211)172-98(59-107(154)200)136(225)176-96(56-73(9)10)134(223)182-102(66-192)139(228)188-116(77(16)193)143(232)171-87)123(212)161-63-109(202)165-85(31-23-25-47-149)124(213)173-95(55-72(7)8)133(222)181-101(65-191)138(227)169-89(41-44-105(152)198)126(215)167-91(43-46-111(204)205)127(216)175-94(54-71(5)6)132(221)177-97(58-82-61-158-68-163-82)135(224)166-86(32-24-26-48-150)125(214)174-93(53-70(3)4)131(220)168-90(42-45-106(153)199)130(219)187-118(79(18)195)145(234)180-100(57-81-37-39-83(197)40-38-81)146(235)190-51-29-35-104(190)140(229)170-88(33-27-49-159-148(156)157)129(218)186-117(78(17)194)144(233)179-99(60-112(206)207)137(226)184-114(74(11)12)141(230)162-62-108(201)164-76(15)121(210)160-64-110(203)183-119(80(19)196)147(236)189-50-28-34-103(189)120(155)209/h37-40,61,68-80,84-104,114-119,191-197H,20-36,41-60,62-67,149-151H2,1-19H3,(H2,152,198)(H2,153,199)(H2,154,200)(H2,155,209)(H,158,163)(H,160,210)(H,161,212)(H,162,230)(H,164,201)(H,165,202)(H,166,224)(H,167,215)(H,168,220)(H,169,227)(H,170,229)(H,171,232)(H,172,211)(H,173,213)(H,174,214)(H,175,216)(H,176,225)(H,177,221)(H,178,231)(H,179,233)(H,180,234)(H,181,222)(H,182,223)(H,183,203)(H,184,226)(H,185,217)(H,186,218)(H,187,219)(H,188,228)(H,204,205)(H,206,207)(H4,156,157,159) > JYSJVJJVLNYRKL-UHFFFAOYSA-N > C148H244N42O47 > 3363.827 > 3361.799403165 > 53 > 481 > 5.213173439179457 > 343.16749259222934 > 0 > 48 > 0 > 0 > 4-[(1-{[1-({5-amino-1-[(1-{[1-({1-[(1-{2-[(4-carbamimidamido-1-{[1-({1-[(1-{[({1-[({[1-(2-carbamoylpyrrolidin-1-yl)-3-hydroxy-1-oxobutan-2-yl]carbamoyl}methyl)carbamoyl]ethyl}carbamoyl)methyl]carbamoyl}-2-methylpropyl)carbamoyl]-2-carboxyethyl}carbamoyl)-2-hydroxypropyl]carbamoyl}butyl)carbamoyl]pyrrolidin-1-yl}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)carbamoyl]-2-hydroxypropyl}carbamoyl)-3-carbamoylpropyl]carbamoyl}-3-methylbutyl)carbamoyl]pentyl}carbamoyl)-2-(1H-imidazol-5-yl)ethyl]carbamoyl}-3-methylbutyl)carbamoyl]-4-(2-{2-[2-(6-amino-2-{2-[2-(2-{[3-amino-6-(carbamoylmethyl)-15-(1-hydroxyethyl)-12-(hydroxymethyl)-9-(2-methylpropyl)-4,7,10,13,16,24-hexaoxo-1-oxa-5,8,11,14,17-pentaazacyclotetracosan-18-yl]formamido}-3-methylbutanamido)-4-methylpentanamido]acetamido}hexanamido)-4-methylpentanamido]-3-hydroxypropanamido}-4-carbamoylbutanamido)butanoic acid > -24.80824655180851 > 1 > 2 > 5 > 2 > 3.9386776899002705 > 3.3256308831393597 > 11.873568364644882 > 1438.9299999999996 > 841.1999000000017 > 96 > 0 > 4-[(1-{[1-({5-amino-1-[(1-{[1-({1-[(1-{2-[(4-carbamimidamido-1-{[1-({1-[(1-{[({1-[({[1-(2-carbamoylpyrrolidin-1-yl)-3-hydroxy-1-oxobutan-2-yl]carbamoyl}methyl)carbamoyl]ethyl}carbamoyl)methyl]carbamoyl}-2-methylpropyl)carbamoyl]-2-carboxyethyl}carbamoyl)-2-hydroxypropyl]carbamoyl}butyl)carbamoyl]pyrrolidin-1-yl}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)carbamoyl]-2-hydroxypropyl}carbamoyl)-3-carbamoylpropyl]carbamoyl}-3-methylbutyl)carbamoyl]pentyl}carbamoyl)-2-(3H-imidazol-4-yl)ethyl]carbamoyl}-3-methylbutyl)carbamoyl]-4-(2-{2-[2-(6-amino-2-{2-[2-(2-{[3-amino-6-(carbamoylmethyl)-15-(1-hydroxyethyl)-12-(hydroxymethyl)-9-(2-methylpropyl)-4,7,10,13,16,24-hexaoxo-1-oxa-5,8,11,14,17-pentaazacyclotetracosan-18-yl]formamido}-3-methylbutanamido)-4-methylpentanamido]acetamido}hexanamido)-4-methylpentanamido]-3-hydroxypropanamido}-4-carbamoylbutanamido)butanoic acid > 0 > DB13742 > experimental > Elcatonin > Elcatonin; Elcatonina $$$$