basic_info |
|
| Product_Name： | DMGLAGRCQH HPRNCPGFN |
| EnglishSynonyms： | DMGLAGRCQH HPRNCPGFN ; VD1/RPD2 ALPHA PEPTIDE |
| pro_mdlNumber： | MFCD18252182 |
| pro_acceptors： | 57 |
| pro_donors： | 30 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N4CCC[C@H]4C(=O)NCC(=O)N[C@@H](Cc5ccccc5)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)N |
| InChi： | InChI=1S/C86H132N32O25S3/c1-42(2)26-52(106-66(123)36-100-71(129)51(20-25-146-4)108-70(128)47(87)30-68(125)126)75(133)104-43(3)69(127)99-35-65(122)105-48(14-8-21-97-85(91)92)72(130)115-58(38-144)79(137)109-50(18-19-62(88)119)74(132)111-54(28-45-33-95-40-102-45)77(135)113-56(29-46-34-96-41-103-46)82(140)118-24-11-17-61(118)81(139)110-49(15-9-22-98-86(93)94)73(131)112-55(31-63(89)120)78(136)116-59(39-145)83(141)117-23-10-16-60(117)80(138)101-37-67(124)107-53(27-44-12-6-5-7-13-44)76(134)114-57(84(142)143)32-64(90)121/h5-7,12-13,33-34,40-43,47-61,144-145H,8-11,14-32,35-39,87H2,1-4H3,(H2,88,119)(H2,89,120)(H2,90,121)(H,95,102)(H,96,103)(H,99,127)(H,100,129)(H,101,138)(H,104,133)(H,105,122)(H,106,123)(H,107,124)(H,108,128)(H,109,137)(H,110,139)(H,111,132)(H,112,131)(H,113,135)(H,114,134)(H,115,130)(H,116,136)(H,125,126)(H,142,143)(H4,91,92,97)(H4,93,94,98)/t43-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1 |
| InChiKey： | InChIKey=RBDLERJHZWTVCU-MVLVXBKGSA-N |
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