NSC243022

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Creator
US National Cancer Institute
Publication Date
2006-04-27
Alternative Title
Cinerubin A hydrochloride
Cinerubine A, hydrochloride
CINERUBIN A HCL
CL 86-F2 HCl
CL-86-F2-hydrochloride
1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5, 7,10-tetrahydroxy-6,11-dioxo-4-[[O-2,3, 6-trideoxy-.alpha.-L-glycerohexopyranos-4-ulosyl-(1-4)-O-2, 6-dideoxy-.alpha.-L-lyxo-hexopyranosyl-(1-4)-2,3, 6-trideoxy-3-(dimethylamino)-.alpha.-L-lyxo-hexopyranosyl]oxy]-, methyl ester, hydrochloride, (1R-(1.alpha.,2.beta.,4.beta.))-
1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5, 7,10-tetrahydroxy-6,11-dioxo-4-(O-2,3, 6-trideoxy-.alpha.-L-glycero-hexopyranos-4-ulosyl-(1-4)-O-2, 6-dideoxy-.alpha.-L-lyxo-hexopyranosyl-(1-4)-2,3, 6-trideoxy-3-(dimethylamino)-.alpha.-L-lyxo-hexopyranosyloxy)-, methyl ester, hydrochloride [1R-(1.alpha.,2.beta.,4.beta.)]-
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2006). NSC243022. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/149104
Identifiers
NSC243022
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/149104
IUPAC Chemical Identifier (IChI): C42H53NO16,1H3-11H2-42(52H)16H2-33H(25-18(39H(42)29(47)53-7H3)10H-17-22(28(25)50H)27(46)24-20(49H)9H-8H-19(48H)23(24)26(17)45)57-37H-14H2-34H(43(5H3)6H3)40H(31H(3H3)55-37)59-38H-15H2-35H(51H)41H(32H(4H3)56-38)58-36H-13H2-12H2-21(44)30H(2H3)54-36
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C42H53NO16/c1-8-42(52)16-27(31-20(35(42)41(51)53-7)13-21-32(37(31)49)38(50)34-25(46)10-9-24(45)33(34)36(21)48)57-29-14-22(43(5)6)39(18(3)55-29)59-30-15-26(47)40(19(4)56-30)58-28-12-11-23(44)17(2)54-28/h9-10,13,17-19,22,26-30,35,39-40,45-47,49,52H,8,11-12,14-16H2,1-7H3/t17-,18-,19-,22+,26+,27+,28+,29+,30+,35+,39-,40-,42-/m1/s1
IUPAC/NIST Chemical Identifier Key (INChI): STUJMJDONFVTGM-CIRJMVAYSA-N