Basic Information |
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| Product Name： | DBI (22-50), HUMAN |
| English Synonyms： | GLU-GLU-MET-LEU-PHE-ILE-TYR-GLY-HIS-TYR-LYS-GLN-ALA-THR-VAL-GLY-ASP-ILE-ASN-THR-GLU-ARG-PRO-GLY-MET-LEU-ASP-PHE-THR ; DBI (22-50), HUMAN |
| MDL Number.： | MFCD00273663 |
| H bond acceptor： | 81 |
| H bond donor： | 44 |
| Smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)NCC(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](Cc3ccc(cc3)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N4CCC[C@H]4C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc5ccccc5)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)NC(=O)[C@H](Cc6ccccc6)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)N |
| InChi： | InChI=1S/C145H215N35O46S2/c1-17-73(9)115(175-133(214)97(57-79-27-21-19-22-28-79)169-128(209)93(55-70(3)4)167-127(208)91(50-54-228-16)163-124(205)88(43-47-110(193)194)161-121(202)86(146)41-46-109(191)192)139(220)172-95(59-81-33-37-84(184)38-34-81)122(203)153-66-107(189)159-99(61-83-65-151-69-156-83)131(212)168-96(60-82-35-39-85(185)40-36-82)130(211)162-87(42-45-104(147)186)123(204)157-75(11)120(201)177-118(77(13)182)142(223)174-114(72(7)8)138(219)155-68-108(190)160-101(63-112(197)198)136(217)176-116(74(10)18-2)140(221)173-100(62-105(148)187)135(216)178-117(76(12)181)141(222)164-89(44-48-111(195)196)125(206)165-92(31-25-51-152-145(149)150)143(224)180-52-26-32-103(180)137(218)154-67-106(188)158-90(49-53-227-15)126(207)166-94(56-71(5)6)129(210)171-102(64-113(199)200)132(213)170-98(58-80-29-23-20-24-30-80)134(215)179-119(78(14)183)144(225)226/h19-24,27-30,33-40,65,69-78,86-103,114-119,181-185H,17-18,25-26,31-32,41-64,66-68,146H2,1-16H3,(H2,147,186)(H2,148,187)(H,151,156)(H,153,203)(H,154,218)(H,155,219)(H,157,204)(H,158,188)(H,159,189)(H,160,190)(H,161,202)(H,162,211)(H,163,205)(H,164,222)(H,165,206)(H,166,207)(H,167,208)(H,168,212)(H,169,209)(H,170,213)(H,171,210)(H,172,220)(H,173,221)(H,174,223)(H,175,214)(H,176,217)(H,177,201)(H,178,216)(H,179,215)(H,191,192)(H,193,194)(H,195,196)(H,197,198)(H,199,200)(H,225,226)(H4,149,150,152)/t73-,74-,75-,76+,77+,78+,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,114-,115-,116-,117-,118-,119-/m0/s1 |
| InChiKey： | InChIKey=KGYPGNWVKXNZEJ-IDZHLEOCSA-N |
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