NSC65866
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Creator
US National Cancer Institute
Publication Date
2005-08-23Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC65866
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/60122
IUPAC Chemical Identifier (IChI): C40H36N12O12S4,1H3-21-17H-31(37(43H2)39(35(21)41H2)51-45-25-9H-13H-29(14H-10H-25)65(53,54)61H)49-47-27-7H-5H-23(33(19H-27)67(57,58)63H)3H-4H-24-6H-8H-28(20H-34(24)68(59,60)64H)48-50-32-18H-22(2H3)36(42H2)40(38(32)44H2)52-46-26-11H-15H-30(16H-12H-26)66(55,56)62H
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C40H36N12O12S4/c1-21-17-31(37(43)39(35(21)41)51-45-25-9-13-29(14-10-25)65(53,54)55)49-47-27-7-5-23(33(19-27)67(59,60)61)3-4-24-6-8-28(20-34(24)68(62,63)64)48-50-32-18-22(2)36(42)40(38(32)44)52-46-26-11-15-30(16-12-26)66(56,57)58/h3-20H,41-44H2,1-2H3,(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64)/b4-3+,49-47+,50-48+,51-45+,52-46+
IUPAC/NIST Chemical Identifier Key (INChI): NIOOKEZGWMUXHI-AARYWVNJSA-N