PTH 2-34 HUMAN

CAS号
CCD编号
CCD03477763
分子式
C178 H286 N54 O49 S2
分子量
4030.68

基本信息

产品名称: PTH 2-34 HUMAN
英文同义词: VAL-SER-GLU-ILE-GLN-LEU-MET-HIS-ASN-LEU-GLY-LYS-HIS-LEU-ASN-SER-MET-GLU-ARG-VAL-GLU-TRP-LEU-ARG-LYS-LYS-LEU-GLN-ASP-VAL-HIS-ASN-PHE-OH ; VAL-SER-GLU-ILE-GLN-LEU-MET-HIS-ASN-LEU-GLY-LYS-HIS-LEU-ASN-SER-MET-GLU-ARG-VAL-GLU-TRP-LEU-ARG-LYS-LYS-LEU-GLN-ASP-VAL-HIS-ASN-PHE ; PTH 2-34 HUMAN
MDL号: MFCD17215232
氢键受体数量: 103
氢键供体数量: 58
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc3c[nH]c4c3cccc4)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc5c[nH]cn5)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc6ccccc6)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C(C)C)N
InChi: InChI=1S/C178H286N54O49S2/c1-21-95(18)144(232-157(261)112(48-53-139(245)246)209-171(275)130(83-234)229-172(276)141(187)92(12)13)175(279)213-109(45-50-132(183)236)152(256)216-117(65-89(6)7)160(264)210-114(55-62-283-20)155(259)221-122(71-99-79-193-85-200-99)164(268)223-124(73-133(184)237)166(270)214-115(63-87(2)3)145(249)198-81-136(240)202-103(39-27-30-56-179)146(250)220-121(70-98-78-192-84-199-98)163(267)218-119(67-91(10)11)161(265)222-126(75-135(186)239)168(272)228-129(82-233)170(274)211-113(54-61-282-19)154(258)207-110(46-51-137(241)242)150(254)205-107(43-34-60-196-178(190)191)156(260)230-142(93(14)15)173(277)212-111(47-52-138(243)244)153(257)219-120(69-97-77-197-102-38-26-25-37-101(97)102)162(266)217-118(66-90(8)9)158(262)206-106(42-33-59-195-177(188)189)148(252)203-104(40-28-31-57-180)147(251)204-105(41-29-32-58-181)149(253)215-116(64-88(4)5)159(263)208-108(44-49-131(182)235)151(255)225-127(76-140(247)248)169(273)231-143(94(16)17)174(278)226-123(72-100-80-194-86-201-100)165(269)224-125(74-134(185)238)167(271)227-128(176(280)281)68-96-35-23-22-24-36-96/h22-26,35-38,77-80,84-95,103-130,141-144,197,233-234H,21,27-34,39-76,81-83,179-181,187H2,1-20H3,(H2,182,235)(H2,183,236)(H2,184,237)(H2,185,238)(H2,186,239)(H,192,199)(H,193,200)(H,194,201)(H,198,249)(H,202,240)(H,203,252)(H,204,251)(H,205,254)(H,206,262)(H,207,258)(H,208,263)(H,209,275)(H,210,264)(H,211,274)(H,212,277)(H,213,279)(H,214,270)(H,215,253)(H,216,256)(H,217,266)(H,218,267)(H,219,257)(H,220,250)(H,221,259)(H,222,265)(H,223,268)(H,224,269)(H,225,255)(H,226,278)(H,227,271)(H,228,272)(H,229,276)(H,230,260)(H,231,273)(H,232,261)(H,241,242)(H,243,244)(H,245,246)(H,247,248)(H,280,281)(H4,188,189,195)(H4,190,191,196)/t95-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,141-,142-,143-,144-/m0/s1
InChiKey: InChIKey=TVPQZJGROFXJTQ-AYGZAXQKSA-N

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