NSC65868

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Creator
US National Cancer Institute
Publication Date
2005-08-23
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2005). NSC65868. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/60124
Identifiers
NSC65868
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/60124
IUPAC Chemical Identifier (IChI): C42H32N6O14S4,1H3-23-17H-29(13H-15H-35(23)45-43-27-19H-33-31(39(21H-27)65(55,56)61H)5H-3H-7H-37(33)63(51,52)59H)47H-41(49)25-9H-11H-26(12H-10H-25)42(50)48H-30-14H-16H-36(24(2H3)18H-30)46-44-28-20H-34-32(40(22H-28)66(57,58)62H)6H-4H-8H-38(34)64(53,54)60H
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C42H32N6O14S4/c1-23-17-27(13-15-35(23)47-45-29-19-33-31(39(21-29)65(57,58)59)5-3-7-37(33)63(51,52)53)43-41(49)25-9-11-26(12-10-25)42(50)44-28-14-16-36(24(2)18-28)48-46-30-20-34-32(40(22-30)66(60,61)62)6-4-8-38(34)64(54,55)56/h3-22H,1-2H3,(H,43,49)(H,44,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)/b47-45+,48-46+
IUPAC/NIST Chemical Identifier Key (INChI): BDIWWZBFPSPBBE-MLGMXDONSA-N