basic_info |
|
| Product_Name: | S2 |
| CAS: | 134439-74-0 |
| EnglishSynonyms: | SER-GLY-PRO-TYR-SER-PHE-ASN-SER-GLY-LEU-THR-PHE-NH2 ; S2 ; SALMF AMIDE 2 |
| pro_mdlNumber: | MFCD00145267 |
| pro_acceptors: | 32 |
| pro_donors: | 18 |
| pro_smile: | CC(C)C[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@@H]4CCCN4C(=O)CNC(=O)[C@H](CO)N |
| InChi: | InChI=1S/C59H82N14O18/c1-31(2)21-39(56(88)72-49(32(3)77)59(91)66-38(50(62)82)22-33-11-6-4-7-12-33)65-47(80)26-63-52(84)43(29-75)70-55(87)42(25-46(61)79)68-53(85)40(23-34-13-8-5-9-14-34)67-57(89)44(30-76)71-54(86)41(24-35-16-18-36(78)19-17-35)69-58(90)45-15-10-20-73(45)48(81)27-64-51(83)37(60)28-74/h4-9,11-14,16-19,31-32,37-45,49,74-78H,10,15,20-30,60H2,1-3H3,(H2,61,79)(H2,62,82)(H,63,84)(H,64,83)(H,65,80)(H,66,91)(H,67,89)(H,68,85)(H,69,90)(H,70,87)(H,71,86)(H,72,88)/t32-,37+,38+,39+,40+,41+,42+,43+,44+,45+,49+/m1/s1 |
| InChiKey: | InChIKey=ULORYJBIPHKGST-MMPVZCTRSA-N |
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