NSC5069

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Creator
US National Cancer Institute
Publication Date
2004-12-13
Alternative Title
Cacotheline (8CI)
9,10-Secostrychnidin-10-oic acid, 2, 3-dihydro-4-nitro-2,3-dioxo- (9CI)
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2004). NSC5069. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/6415
Identifiers
NSC5069
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/6415
IUPAC Chemical Identifier (IChI): C21H21N3O7,25-11-2H-10-13(14(15(11)27)24(28)29)22H-20H-19H-16H-8H2-18H-21(10,20)4H2-5H2-23(18)7H2-9(16)1H-3H2-31-17H(19)6H2-12(26)30H
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C21H21N3O7/c25-12-6-11-17(18(19(12)28)24(29)30)22-20-16-10-5-14-21(11,20)2-3-23(14)8-9(10)1-4-31-13(16)7-15(26)27/h1,6,10,13-14,16,20,22H,2-5,7-8H2,(H,26,27)/t10-,13-,14-,16-,20-,21+/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): IVEMPCACOMNRGI-OFDJEBHLSA-N