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0 0 0 0 0 0 0 0 0 0 0 0\n 6.2069 -17.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4870 -16.2362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 5.4923 -17.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 6.1516 -13.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 7.6478 -12.5874 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0\n 4.7827 -17.4780 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 4.0625 -17.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.3522 -18.3194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 3.3468 -17.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.0574 -16.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.3373 -15.8418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 3.3344 -15.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.6187 -14.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.6152 -13.7872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 2.6325 -17.0828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 28.0935 -9.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 31.1998 -1.1386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 9.2155 -16.5400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 23.3625 -16.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 24.4507 -14.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 29.6459 -5.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 29.6792 -1.4608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 26.8089 0.1247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 15.9190 -0.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0\n 4 9 1 0\n 12 19 1 0\n 22 31 1 0\n 34 39 1 0\n 42 45 1 0\n 48 52 1 0\n 55 58 1 0\n 61 64 1 0\n 67 68 1 0\n 71 72 1 0\n 75 81 1 0\n 84 87 1 0\n 90 95 1 0\n 98107 1 0\n110113 1 0\n117118 1 0\n121124 1 0\n127131 1 0\n134139 1 0\n142150 1 0\n153157 1 0\n160166 1 0\n169174 1 0\n177183 1 0\n186187 1 0\n190194 1 0\n197200 1 0\n203216 1 0\n219223 1 0\n226227 1 0\n230236 1 0\n240241 1 0\n244250 1 0\n253256 1 0\n259262 1 0\n265271 1 0\n 2 1 1 1\n 2 4 1 0\n 4 3 2 0\n 2 5 1 0\n 5 6 1 0\n 6 7 2 0\n 6 8 1 0\n 10 9 1 6\n 10 12 1 0\n 12 11 2 0\n 10 13 1 0\n 13 18 1 0\n 14 15 1 0\n 15 16 2 0\n 16 17 1 0\n 17 18 2 0\n 18 14 1 0\n 20 19 1 1\n 20 22 1 0\n 22 21 2 0\n 20 23 1 0\n 23 25 1 0\n 24 25 2 0\n 25 26 1 0\n 26 27 2 0\n 27 28 1 0\n 28 29 2 0\n 29 24 1 0\n 28 30 1 0\n 32 31 1 6\n 32 34 1 0\n 34 33 2 0\n 32 35 1 0\n 35 36 1 0\n 36 37 2 0\n 36 38 1 0\n 40 39 1 6\n 40 42 1 0\n 42 41 2 0\n 40 43 1 0\n 43 44 1 0\n 45 46 1 0\n 46 48 1 0\n 48 47 2 0\n 46 49 1 6\n 49 50 1 0\n 49 51 1 0\n 52 53 1 0\n 53 55 1 0\n 55 54 2 0\n 53 56 1 1\n 56 57 1 0\n 58 59 1 0\n 59 61 1 0\n 61 60 2 0\n 59 62 1 6\n 62 63 1 0\n 64 65 1 0\n 65 67 1 0\n 67 66 2 0\n 68 69 1 0\n 69 71 1 0\n 71 70 2 0\n 72 73 1 0\n 73 75 1 0\n 75 74 2 0\n 73 76 1 1\n 76 77 1 0\n 77 78 1 0\n 78 79 2 0\n 78 80 1 0\n 81 82 1 0\n 82 84 1 0\n 84 83 2 0\n 82 85 1 0\n 85 86 1 0\n 87 88 1 0\n 88 90 1 0\n 90 89 2 0\n 88 91 1 1\n 91 92 1 0\n 92 93 1 0\n 92 94 1 0\n 95 96 1 0\n 96 98 1 0\n 98 97 2 0\n 96 99 1 6\n 99101 1 0\n100101 2 0\n101102 1 0\n102103 2 0\n103104 1 0\n104105 2 0\n105100 1 0\n104106 1 0\n107108 1 0\n108110 1 0\n110109 2 0\n108111 1 1\n111112 1 0\n113114 1 0\n114117 1 0\n117115 2 0\n114116 1 6\n119118 1 0\n119121 1 0\n121120 2 0\n119122 1 0\n122123 1 0\n124125 1 0\n125127 1 0\n127126 2 0\n125128 1 0\n129130 1 0\n130128 1 0\n129124 1 0\n131132 1 0\n132134 1 0\n134133 2 0\n132135 1 0\n135136 1 6\n135137 1 0\n137138 1 0\n139140 1 0\n140142 1 0\n142141 2 0\n140143 1 6\n143145 1 0\n144145 2 0\n145146 1 0\n146147 2 0\n147148 1 0\n148149 2 0\n149144 1 0\n151150 1 0\n151153 1 0\n153152 2 0\n151154 1 0\n154155 1 1\n154156 1 0\n157158 1 0\n158160 1 0\n160159 2 0\n158161 1 6\n161162 1 0\n162163 1 0\n163164 1 0\n164165 1 0\n166167 1 0\n167169 1 0\n169168 2 0\n167170 1 0\n170171 1 6\n170172 1 0\n172173 1 0\n174175 1 0\n175177 1 0\n177176 2 0\n175178 1 6\n178179 1 0\n179180 1 0\n180181 2 0\n180182 1 0\n183184 1 0\n184186 1 0\n186185 2 0\n188187 1 0\n188190 1 0\n190189 2 0\n188191 1 0\n191192 1 6\n191193 1 0\n195194 1 0\n195197 1 0\n197196 2 0\n195198 1 0\n198199 1 0\n200201 1 0\n201203 1 0\n203202 2 0\n201204 1 6\n204206 1 0\n205206 2 0\n206207 1 0\n207208 2 0\n208209 1 0\n209210 2 0\n210205 1 0\n209211 1 0\n212213 1 0\n213214 1 0\n213215 2 0\n216217 1 0\n217219 1 0\n219218 2 0\n217220 1 1\n220221 1 0\n221222 1 0\n222212 1 0\n223224 1 0\n224226 1 0\n226225 2 0\n227228 1 0\n228230 1 0\n230229 2 0\n228231 1 1\n231232 1 0\n232233 1 0\n233234 1 0\n234235 1 0\n236237 1 0\n237240 1 0\n240238 2 0\n237239 1 6\n241242 1 0\n242244 1 0\n244243 2 0\n242245 1 1\n245246 1 0\n246247 1 0\n247248 1 0\n248249 1 0\n250251 1 0\n251253 1 0\n253252 2 0\n251254 1 0\n254255 1 0\n257256 1 0\n257259 1 6\n259258 2 0\n257260 1 0\n260261 1 0\n263262 1 6\n263265 1 0\n265264 2 0\n263266 1 0\n266267 1 0\n267268 1 0\n268269 1 0\n269270 1 0\n 44255 1 0\n199 86 1 0\n261123 1 0\n167272 1 6\n132273 1 6\n251274 1 1\n195275 1 1\n188276 1 1\n151277 1 6\n125278 1 1\n119279 1 1\n 82280 1 1\nM END\n> \nCHEMBL508138\n\n> \nNone", "standard_inchi": "InChI=1S/C167H256N48O50S6/c1-13-83(7)131-161(259)192-102(48-50-122(173)224)139(237)183-70-128(230)210-133(87(11)219)163(261)208-118-77-268-266-75-116-155(253)195-105(58-81(3)4)145(243)196-108(62-92-40-46-96(223)47-41-92)148(246)202-113(72-217)152(250)186-86(10)136(234)209-120(165(263)215-57-27-35-121(215)159(257)213-132(84(8)14-2)162(260)200-109(59-89-28-16-15-17-29-89)151(249)214-134(88(12)220)164(262)191-101(144(242)212-131)32-20-24-54-170)79-271-270-74-115(154(252)193-104(166(264)265)33-21-25-55-171)207-157(255)117(204-142(240)100(31-19-23-53-169)189-135(233)85(9)185-141(239)99(30-18-22-52-168)187-127(229)69-182-138(236)98(34-26-56-179-167(176)177)190-146(244)106(198-156(118)254)60-90-36-42-94(221)43-37-90)76-267-269-78-119(158(256)211-130(82(5)6)160(258)203-114(73-218)153(251)201-112(71-216)140(238)181-67-125(227)180-68-126(228)188-103(143(241)205-116)49-51-123(174)225)206-150(248)111(65-124(175)226)199-147(245)107(61-91-38-44-95(222)45-39-91)197-149(247)110(63-93-66-178-80-184-93)194-137(235)97(172)64-129(231)232/h15-17,28-29,36-47,66,80-88,97-121,130-134,216-223H,13-14,18-27,30-35,48-65,67-79,168-172H2,1-12H3,(H2,173,224)(H2,174,225)(H2,175,226)(H,178,184)(H,180,227)(H,181,238)(H,182,236)(H,183,237)(H,185,239)(H,186,250)(H,187,229)(H,188,228)(H,189,233)(H,190,244)(H,191,262)(H,192,259)(H,193,252)(H,194,235)(H,195,253)(H,196,243)(H,197,247)(H,198,254)(H,199,245)(H,200,260)(H,201,251)(H,202,246)(H,203,258)(H,204,240)(H,205,241)(H,206,248)(H,207,255)(H,208,261)(H,209,234)(H,210,230)(H,211,256)(H,212,242)(H,213,257)(H,214,249)(H,231,232)(H,264,265)(H4,176,177,179)/t83-,84-,85-,86-,87+,88+,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,130-,131-,132-,133-,134-/m0/s1", "standard_inchi_key": "CLAFBNXESHRGJL-YYSGPKNVSA-N"}, "molecule_synonyms": [], "molecule_type": "Protein", "natural_product": 0, "oral": false, "orphan": -1, "parenteral": false, "polymer_flag": 0, "pref_name": null, "prodrug": -1, "structure_type": "BOTH", "therapeutic_flag": false, "topical": false, "usan_stem": null, "usan_stem_definition": null, "usan_substem": null, "usan_year": null, "veterinary": -1, "withdrawn_flag": false}