NSC56714
Creator
US National Cancer Institute
Publication Date
2005-08-23Alternative Title
Butanoic acid, 4-[[[[[4-(dimethylamino)-1,4,4a,5,5a,6,11, 12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-2-naphthacenyl]carbonyl]amino]methyl]amino]-, monosodium salt, (4.alpha.,4a.alpha.,5a.alpha.,6.beta.,12a.alpha.)-(.+-.)-
Butyric acid, DL-4-[[[4-(dimethylamino)-1,4,4a,5,5a,6,11, 12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-2-naphthacenecarboxamido]methyl]amino]-, sodium salt
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC56714
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/54342
IUPAC Chemical Identifier (IChI): C27H33N3O10,1H3-26(39H)12-5H-4H-6H-13(35H)15(12)18(32)17-21(38H)27(40H)20(33)16(22(34)29H-11H2-28H-9H2-7H2-8H2-14(31)36H)19(37H)25H(30(2H3)3H3)24H(27)10H2-23H(17)26
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C27H33N3O10/c1-26(39)12-6-4-7-15(31)17(12)21(34)18-13(26)10-14-20(30(2)3)22(35)19(24(37)27(14,40)23(18)36)25(38)29-11-28-9-5-8-16(32)33/h4,6-7,13-14,20,28,31,35-36,39-40H,5,8-11H2,1-3H3,(H,29,38)(H,32,33)/t13-,14-,20-,26+,27-/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): NEHCTVLFMPRTBP-VGCZKNFVSA-N