基本信息 |
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| 产品名称： | BAD (103-127), HUMAN, FAM-LABELED |
| 英文同义词： | FAM-NLWAAQRYGRELRRMSDEFVDSFKK ; BAD (103-127), HUMAN, FAM-LABELED ; FAM-ASN-LEU-TRP-ALA-ALA-GLN-ARG-TYR-GLY-ARG-GLU-LEU-ARG-ARG-MET-SER-ASP-GLU-PHE-VAL-ASP-SER-PHE-LYS-LYS-OH |
| MDL号： | MFCD08459484 |
| 氢键受体数量： | 87 |
| 氢键供体数量： | 52 |
| Smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc4c[nH]c5c4cccc5)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)c6ccc7c(c6)C(=O)OC78c9ccc(cc9Oc1c8ccc(c1)O)O |
| InChi： | InChI=1S/C158H222N42O45S/c1-78(2)62-107(142(231)184-100(36-24-59-173-156(167)168)133(222)181-99(35-23-58-172-155(165)166)134(223)187-105(54-61-246-9)140(229)198-116(76-201)150(239)196-114(72-125(213)214)146(235)186-104(50-53-124(211)212)139(228)193-111(65-84-28-14-11-15-29-84)148(237)200-127(80(5)6)151(240)197-115(73-126(215)216)147(236)199-117(77-202)149(238)194-110(64-83-26-12-10-13-27-83)144(233)183-98(32-18-20-55-159)135(224)188-106(152(241)242)33-19-21-56-160)190-138(227)103(49-52-123(209)210)185-132(221)97(34-22-57-171-154(163)164)179-122(208)75-176-131(220)109(66-85-38-41-88(203)42-39-85)192-136(225)101(37-25-60-174-157(169)170)182-137(226)102(48-51-120(161)206)180-129(218)82(8)177-128(217)81(7)178-141(230)112(68-87-74-175-96-31-17-16-30-91(87)96)195-143(232)108(63-79(3)4)191-145(234)113(71-121(162)207)189-130(219)86-40-45-93-92(67-86)153(243)245-158(93)94-46-43-89(204)69-118(94)244-119-70-90(205)44-47-95(119)158/h10-17,26-31,38-47,67,69-70,74,78-82,97-117,127,175,201-205H,18-25,32-37,48-66,68,71-73,75-77,159-160H2,1-9H3,(H2,161,206)(H2,162,207)(H,176,220)(H,177,217)(H,178,230)(H,179,208)(H,180,218)(H,181,222)(H,182,226)(H,183,233)(H,184,231)(H,185,221)(H,186,235)(H,187,223)(H,188,224)(H,189,219)(H,190,227)(H,191,234)(H,192,225)(H,193,228)(H,194,238)(H,195,232)(H,196,239)(H,197,240)(H,198,229)(H,199,236)(H,200,237)(H,209,210)(H,211,212)(H,213,214)(H,215,216)(H,241,242)(H4,163,164,171)(H4,165,166,172)(H4,167,168,173)(H4,169,170,174)/t81-,82-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,127-/m0/s1 |
| InChiKey： | InChIKey=LZGPQELYZNZNKJ-LXHFGOSASA-N |
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