ARG-PHE-ALA-VAL-ARG-ASP-MET-ARG-GLN-THR-VAL-ALA-VAL-GLY-VAL-ILE-LYS-ALA-VAL-ASP-LYS-LYS

CAS No.
CCD No.
CCD00580404
Formula
C109 H191 N35 O29 S
MolWeight
2487.99

Basic Information

Product Name: ARG-PHE-ALA-VAL-ARG-ASP-MET-ARG-GLN-THR-VAL-ALA-VAL-GLY-VAL-ILE-LYS-ALA-VAL-ASP-LYS-LYS
English Synonyms: ARG-PHE-ALA-VAL-ARG-ASP-MET-ARG-GLN-THR-VAL-ALA-VAL-GLY-VAL-ILE-LYS-ALA-VAL-ASP-LYS-LYS
MDL Number.: MFCD07366709
H bond acceptor: 64
H bond donor: 39
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)N
InChi: InChI=1S/C109H191N35O29S/c1-18-58(12)84(104(170)133-65(34-22-25-42-110)90(156)125-59(13)86(152)141-83(57(10)11)102(168)137-74(51-78(150)151)98(164)129-66(35-23-26-43-111)92(158)134-71(106(172)173)36-24-27-44-112)143-103(169)80(54(4)5)138-76(147)52-124-99(165)79(53(2)3)139-88(154)61(15)127-100(166)81(55(6)7)142-105(171)85(62(16)145)144-95(161)69(39-40-75(114)146)130-91(157)67(37-29-46-122-108(117)118)128-94(160)70(41-48-174-17)131-97(163)73(50-77(148)149)136-93(159)68(38-30-47-123-109(119)120)132-101(167)82(56(8)9)140-87(153)60(14)126-96(162)72(49-63-31-20-19-21-32-63)135-89(155)64(113)33-28-45-121-107(115)116/h19-21,31-32,53-62,64-74,79-85,145H,18,22-30,33-52,110-113H2,1-17H3,(H2,114,146)(H,124,165)(H,125,156)(H,126,162)(H,127,166)(H,128,160)(H,129,164)(H,130,157)(H,131,163)(H,132,167)(H,133,170)(H,134,158)(H,135,155)(H,136,159)(H,137,168)(H,138,147)(H,139,154)(H,140,153)(H,141,152)(H,142,171)(H,143,169)(H,144,161)(H,148,149)(H,150,151)(H,172,173)(H4,115,116,121)(H4,117,118,122)(H4,119,120,123)/t58-,59-,60-,61-,62+,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,79-,80-,81-,82-,83-,84-,85-/m0/s1
InChiKey: InChIKey=WFINYYVNOFQKBK-CEZQXKOLSA-N

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