BIOT-GGVAHVVANPQAEGQL-AMIDE_Chemical Cloud Database

BIOT-GGVAHVVANPQAEGQL-AMIDE

Basic Information
Product Name：	BIOT-GGVAHVVANPQAEGQL-AMIDE
English Synonyms：	TNF-ALPHA (13-26) BIOTINYL/AMIDE [HOMO SAPIENS] ; BIOT-GGVAHVVANPQAEGQL-AMIDE
MDL Number.：	MFCD08274438
H bond acceptor：	47
H bond donor：	23
Smile：	CC(C)C[C@@H](C(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4
InChi：	InChI=1S/C76H122N24O23S/c1-34(2)25-45(63(80)110)92-69(116)43(18-21-51(77)101)89-56(106)31-84-67(114)42(20-23-58(108)109)90-64(111)38(9)86-68(115)44(19-22-52(78)102)91-71(118)49-15-14-24-100(49)75(122)47(27-53(79)103)94-66(113)40(11)88-73(120)60(36(5)6)98-74(121)61(37(7)8)97-70(117)46(26-41-28-81-33-85-41)93-65(112)39(10)87-72(119)59(35(3)4)96-57(107)30-83-55(105)29-82-54(104)17-13-12-16-50-62-48(32-124-50)95-76(123)99-62/h28,33-40,42-50,59-62H,12-27,29-32H2,1-11H3,(H2,77,101)(H2,78,102)(H2,79,103)(H2,80,110)(H,81,85)(H,82,104)(H,83,105)(H,84,114)(H,86,115)(H,87,119)(H,88,120)(H,89,106)(H,90,111)(H,91,118)(H,92,116)(H,93,112)(H,94,113)(H,96,107)(H,97,117)(H,98,121)(H,108,109)(H2,95,99,123)/t38-,39-,40-,42-,43-,44-,45-,46-,47-,48-,49-,50-,59-,60-,61-,62-/m0/s1
InChiKey：	InChIKey=JPGJZTWYGSYKCP-JCVAVFIASA-N

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