NSC145634
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Creator
US National Cancer Institute
Publication Date
2006-01-13Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC145634
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/113163
IUPAC Chemical Identifier (IChI): C40H54N2O12,1H3-16H2-41H-17H2-21-25-28(48H)23-22(27(21)47H)24-29(19(3H3)26(23)46H)54-40(9H3,30(24)44)52-15H-14H-36H(51-10H3)33H(6H3)39H(53-20(4H3)43)35H(8H3)38H(50H)34H(7H3)37H(49H)32H(5H3)13H-11H-12H-18(2H3)31(45)42H-25
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C40H54N2O12/c1-11-41-17-25-30-35(48)28-27(34(25)47)29-37(23(7)33(28)46)54-40(9,38(29)49)52-16-15-26(51-10)20(4)36(53-24(8)43)22(6)32(45)21(5)31(44)18(2)13-12-14-19(3)39(50)42-30/h12-16,18,20-22,26,31-32,36,41,44-48H,11,17H2,1-10H3,(H,42,50)/b13-12+,16-15+,19-14-/t18-,20+,21-,22-,26-,31-,32-,36+,40+/m1/s1
IUPAC/NIST Chemical Identifier Key (INChI): SIBVBKHRYDYBGO-ZPWFRSGLSA-N