basic_info |
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Product_Name: | HYPEPTIN |
CAS: | 124883-38-1 |
EnglishSynonyms: | HYPEPTIN |
pro_mdlNumber: | MFCD00886574 |
pro_acceptors: | 28 |
pro_donors: | 17 |
pro_smile: | CC[C@H](C)[C@H]1C(=O)O[C@H]([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)[C@@H](C(C)C)O)[C@@H](c2ccc(cc2)O)O)NC(=O)[C@H]([C@H](C(=O)N)O)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N |
InChi: | InChI=1S/C44H71N13O15/c1-8-19(6)25-43(71)72-33(35(47)63)29(42(70)56-27(31(60)21-11-13-22(58)14-12-21)40(68)55-26(39(67)53-25)30(59)18(4)5)57-41(69)28(32(61)34(46)62)54-37(65)23(10-9-15-50-44(48)49)51-38(66)24(16-17(2)3)52-36(64)20(7)45/h11-14,17-20,23-33,58-61H,8-10,15-16,45H2,1-7H3,(H2,46,62)(H2,47,63)(H,51,66)(H,52,64)(H,53,67)(H,54,65)(H,55,68)(H,56,70)(H,57,69)(H4,48,49,50)/t19-,20-,23+,24+,25-,26-,27-,28-,29+,30+,31+,32+,33+/m0/s1 |
InChiKey: | InChIKey=FZKVQDUEWNYBMS-YMDVCATJSA-N |
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