basic_info |
|
| Product_Name: | (HYP3)-BRADYKININ ACETATE SALT |
| EnglishSynonyms: | H-ARG-PRO-HYP-GLY-PHE-SER-PRO-PHE-ARG-OH ACETATE SALT ; (HYP3)-BRADYKININ ACETATE SALT |
| pro_mdlNumber: | MFCD18782283 |
| pro_acceptors: | 27 |
| pro_donors: | 15 |
| pro_smile: | CC(=O)O.c1ccc(cc1)C[C@@H](C(=O)N[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CNC(=O)[C@@H]4C[C@H](CN4C(=O)[C@@H]5CCCN5C(=O)[C@H](CCCNC(=N)N)N)O |
| InChi: | InChI=1S/C50H73N15O12.C2H4O2/c51-32(15-7-19-56-49(52)53)45(73)64-22-10-18-38(64)47(75)65-27-31(67)25-39(65)43(71)58-26-40(68)59-34(23-29-11-3-1-4-12-29)41(69)62-36(28-66)46(74)63-21-9-17-37(63)44(72)61-35(24-30-13-5-2-6-14-30)42(70)60-33(48(76)77)16-8-20-57-50(54)55;1-2(3)4/h1-6,11-14,31-39,66-67H,7-10,15-28,51H2,(H,58,71)(H,59,68)(H,60,70)(H,61,72)(H,62,69)(H,76,77)(H4,52,53,56)(H4,54,55,57);1H3,(H,3,4)/t31-,32+,33+,34+,35+,36+,37+,38+,39+;/m1./s1 |
| InChiKey: | InChIKey=WSHIFZYKCOICKC-LYWFQIEGSA-N |
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