basic_info |
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Product_Name: | WWAMIDE-3 |
CAS: | 149636-89-5 |
EnglishSynonyms: | WKQMSVW-NH2 ; H-TRP-LYS-GLN-MET-SER-VAL-TRP-NH2 ; WWAMIDE-3 |
pro_mdlNumber: | MFCD00237323 |
pro_acceptors: | 21 |
pro_donors: | 13 |
pro_smile: | CC(C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]c4c3cccc4)N |
InChi: | InChI=1S/C46H66N12O9S/c1-25(2)39(46(67)56-36(40(50)61)21-27-23-52-32-13-7-5-11-29(27)32)58-45(66)37(24-59)57-44(65)35(17-19-68-3)55-43(64)34(15-16-38(49)60)54-42(63)33(14-8-9-18-47)53-41(62)30(48)20-26-22-51-31-12-6-4-10-28(26)31/h4-7,10-13,22-23,25,30,33-37,39,51-52,59H,8-9,14-21,24,47-48H2,1-3H3,(H2,49,60)(H2,50,61)(H,53,62)(H,54,63)(H,55,64)(H,56,67)(H,57,65)(H,58,66)/t30-,33-,34-,35-,36-,37-,39-/m0/s1 |
InChiKey: | InChIKey=ZQWIXJGSXPNQQN-GURSNEKKSA-N |
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