阴茎(6CI,7CI,8CI,9CI)(28227-92-1)名称与标识符
名称
英文别名:
Phalloin(6CI,7CI,8CI,9CI);Phalloine;Q9257868;NS00126146;28227-92-1;18-hydroxy-34-(1-hydroxyethyl)-28-(2-hydroxy-2-methylpropyl)-23,31-dimethyl-12-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone;HSDB 3525;PHALLOIN;Phalloidin, 7-(4-hydroxy-L-leucine)-;DTXSID401046318;
标识符
InChIKey:
VVAHMTWEOWYEHQ-UHFFFAOYSA-N
Inchi:
1S/C35H48N8O10S/c1-15-27(46)38-22-11-20-19-8-6-7-9-21(19)41-33(20)54-14-24(34(52)43-13-18(45)10-25(43)31(50)37-15)40-32(51)26(17(3)44)42-28(47)16(2)36-30(49)23(39-29(22)48)12-35(4,5)53/h6-9,15-18,22-26,41,44-45,53H,10-14H2,1-5H3,(H,36,49)(H,37,50)(H,38,46)(H,39,48)(H,40,51)(H,42,47)
SMILES:
S1C2=C(C3C=CC=CC=3N2)CC2C(NC(C(NC(C)C(NC(C(C)O)C(NC(C1)C(N1CC(CC1C(NC(C)C(N2)=O)=O)O)=O)=O)=O)=O)CC(C)(C)O)=O