NSC65861
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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
NSC65861
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/60118
IUPAC Chemical Identifier (IChI): C39H31N9O7S,1H3-22-20H-33(36(41H2)37(35(22)40H2)47-44-28-12H-6H-25(7H-13H-28)38(49)48H-30-15H-17H-31(18H-16H-30)56(51,52)55H)46-43-27-10H-4H-24(5H-11H-27)23-2H-8H-26(9H-3H-23)42-45-29-14H-19H-34(53H)32(21H-29)39(50)54H
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C39H31N9O7S/c1-22-20-33(36(41)37(35(22)40)48-45-29-12-6-25(7-13-29)38(50)42-26-14-17-31(18-15-26)56(53,54)55)47-44-28-10-4-24(5-11-28)23-2-8-27(9-3-23)43-46-30-16-19-34(49)32(21-30)39(51)52/h2-21,49H,40-41H2,1H3,(H,42,50)(H,51,52)(H,53,54,55)/b46-43+,47-44+,48-45+
IUPAC/NIST Chemical Identifier Key (INChI): ZFFXGMZEQZCKFS-IAXGRCEVSA-N