NSC90592
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Creator
US National Cancer Institute
Publication Date
2005-08-25Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC90592
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/77384
IUPAC Chemical Identifier (IChI): C45H62N6O7S,1H3-29-9H-11H-31(12H-10H-29)59(55,56)50H-35(46H)47H-25H2-15H2-17H2-38H(49H-36(54)58-28H2-30-7H-5H-4H-6H-8H-30)34(53)51-26H2-16H2-18H2-39H(51)33(52)48H-43H-20H2-19H2-42H-40H-14H2-13H-32-27H2-37H(57H)21H2-23H2-44(32,2H3)41H(40)22H2-24H2-45(42,43)3H3
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C45H62N6O7S/c1-29-13-16-33(17-14-29)59(56,57)50-42(46)47-25-7-11-37(48-43(55)58-28-30-9-5-4-6-10-30)41(54)51-26-8-12-38(51)40(53)49-39-20-19-35-34-18-15-31-27-32(52)21-23-44(31,2)36(34)22-24-45(35,39)3/h4-6,9-10,13-17,32,34-39,52H,7-8,11-12,18-28H2,1-3H3,(H,48,55)(H,49,53)(H3,46,47,50)/t32-,34-,35-,36-,37+,38-,39-,44-,45-/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): HNAUZSWFUFTRIF-AUBYHHRBSA-N