basic_info |
|
| Product_Name： | ASN-GLN-GLY-ARG-HIS-PHE-CYS-GLY-GLY-ALA-LEU-ILE-HIS-ALA-ARG-PHE-VAL-MET-THR-ALA-ALA-SER-CYS-PHE-GLN |
| EnglishSynonyms： | CAP 37 (20-44) ; ASN-GLN-GLY-ARG-HIS-PHE-CYS-GLY-GLY-ALA-LEU-ILE-HIS-ALA-ARG-PHE-VAL-MET-THR-ALA-ALA-SER-CYS-PHE-GLN |
| pro_mdlNumber： | MFCD01630768 |
| pro_acceptors： | 69 |
| pro_donors： | 39 |
| pro_smile： | CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)N)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CCC(=O)N)C(=O)O)CO)C)C)[C@@H](C)O)CCSC)C(C)C)Cc5ccccc5)CCCNC(=N)N)C)Cc6c[nH]cn6 |
| InChi： | InChI=1S/C118H178N38O31S3/c1-13-60(6)93-114(184)150-81(45-69-48-127-56-134-69)105(175)138-64(10)97(167)141-73(32-24-39-130-118(125)126)103(173)146-80(44-68-29-21-16-22-30-68)110(180)154-92(59(4)5)113(183)143-75(37-40-188-12)104(174)156-94(65(11)158)115(185)139-62(8)95(165)137-63(9)98(168)151-83(53-157)111(181)153-85(112(182)148-78(42-66-25-17-14-18-26-66)106(176)144-76(116(186)187)34-36-87(121)160)55-190-189-54-84(101(171)132-50-89(162)131-51-90(163)136-61(7)96(166)145-77(41-58(2)3)109(179)155-93)152-107(177)79(43-67-27-19-15-20-28-67)147-108(178)82(46-70-49-128-57-135-70)149-102(172)72(31-23-38-129-117(123)124)140-91(164)52-133-100(170)74(33-35-86(120)159)142-99(169)71(119)47-88(122)161/h14-22,25-30,48-49,56-65,71-85,92-94,157-158H,13,23-24,31-47,50-55,119H2,1-12H3,(H2,120,159)(H2,121,160)(H2,122,161)(H,127,134)(H,128,135)(H,131,162)(H,132,171)(H,133,170)(H,136,163)(H,137,165)(H,138,175)(H,139,185)(H,140,164)(H,141,167)(H,142,169)(H,143,183)(H,144,176)(H,145,166)(H,146,173)(H,147,178)(H,148,182)(H,149,172)(H,150,184)(H,151,168)(H,152,177)(H,153,181)(H,154,180)(H,155,179)(H,156,174)(H,186,187)(H4,123,124,129)(H4,125,126,130)/t60-,61-,62-,63-,64-,65+,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,92-,93-,94-/m0/s1 |
| InChiKey： | InChIKey=MMJWVAJJSPAONJ-YWQAWNPJSA-N |
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