NSC64431
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Creator
US National Cancer Institute
Publication Date
2005-08-23Alternative Title
Butanoic acid, 2-[[[[[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]-4-(methylsulf inyl)-, monosodium salt
Butyric acid, 2-[[[4-(dimethylamino)-1,4, 4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-2-naphthacene-carboxamido]methyl]amino]-4-(methylsulfinyl )-, sodium salt
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC64431
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/59235
IUPAC Chemical Identifier (IChI): C28H35N3O11S,1H3-27(41H)12-6H-5H-7H-13(37H)14(12)17(32)16-20(39H)28(42H)19(33)15(18(38H)26H(31(2H3)3H3)25H(28)10H2-23H(16)27)21(34)29H-11H2-30H-24H(22(35)40H)8H2-9H2-43(4H3)36
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C28H35N3O11S/c1-27(40)12-6-5-7-16(32)17(12)21(33)18-13(27)10-14-20(31(2)3)22(34)19(24(36)28(14,41)23(18)35)25(37)30-11-29-15(26(38)39)8-9-43(4)42/h5-7,13-15,20,29,32,34-35,40-41H,8-11H2,1-4H3,(H,30,37)(H,38,39)/t13-,14+,15+,20+,27+,28-,43-/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): VEVNLCDMYKUCCC-XYIGILHVSA-N