RANATACHYKININ B ,135690-48-1 _Chemical Cloud Database

RANATACHYKININ B

Basic Information
Product Name：	RANATACHYKININ B
CAS：	135690-48-1
English Synonyms：	H-TYR-LYS-SER-ASP-SER-PHE-TYR-GLY-LEU-MET-NH2 ; RANATACHYKININ B ; YKSDSFYGLM-NH2
MDL Number.：	MFCD11113722
H bond acceptor：	28
H bond donor：	17
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(cc3)O)N
InChi：	InChI=1S/C56H80N12O16S/c1-31(2)23-40(52(80)62-38(48(59)76)20-22-85-3)61-46(73)28-60-50(78)41(26-34-14-18-36(72)19-15-34)64-53(81)42(25-32-9-5-4-6-10-32)65-55(83)45(30-70)68-54(82)43(27-47(74)75)66-56(84)44(29-69)67-51(79)39(11-7-8-21-57)63-49(77)37(58)24-33-12-16-35(71)17-13-33/h4-6,9-10,12-19,31,37-45,69-72H,7-8,11,20-30,57-58H2,1-3H3,(H2,59,76)(H,60,78)(H,61,73)(H,62,80)(H,63,77)(H,64,81)(H,65,83)(H,66,84)(H,67,79)(H,68,82)(H,74,75)/t37-,38-,39-,40-,41-,42-,43-,44-,45-/m0/s1
InChiKey：	InChIKey=ONJQALZQTBFYIT-NVAZTIMOSA-N

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