NSC47461

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Creator
US National Cancer Institute
Publication Date
2005-08-22
Alternative Title
-(.beta.,.beta.'-Dichlorodiethylaminomethyl)tetracycline
Tetracycline mustard
TCM
2-Naphthacenecarboxamide, N-[[bis(2-chloroethyl)amino]methyl]-4-(dimethylamino)-1,4,4a,5,5a, 6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-, (4S-(4.alpha.,4a.alpha.,5a.alpha.,6.beta.,12.alpha.))- (9CI)
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2005). NSC47461. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/47933
Identifiers
NSC47461
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/47933
IUPAC Chemical Identifier (IChI): C27H33Cl2N3O8,1H3-26(39H)13-5H-4H-6H-14(36H)15(13)18(33)17-21(38H)27(40H)20(34)16(22(35)30H-12H2-32(9H2-7H2-28)10H2-8H2-29)19(37H)25H(31(2H3)3H3)24H(27)11H2-23H(17)26
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C27H33Cl2N3O8/c1-26(39)13-5-4-6-16(33)17(13)21(34)18-14(26)11-15-20(31(2)3)22(35)19(24(37)27(15,40)23(18)36)25(38)30-12-32(9-7-28)10-8-29/h4-6,14-15,20,33,35-36,39-40H,7-12H2,1-3H3,(H,30,38)/t14-,15-,20-,26+,27-/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): GXHKPILZOLEJQJ-IAHYZSEUSA-N