NSC149583

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Creator
US National Cancer Institute
Publication Date
2006-01-31
Alternative Title
Adriamycin nicotinate
Adriamycin, 14-nicotinate, monohydrochloride
3-Pyridinecarboxylic acid, 2-[4-[(3-amino-2,3, 6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-1,2,3,4,6, 11-hexahydro-2,5,12-trihydroxy-7-methoxy-6, 11-dioxo-2-naphthacenyl]-2-oxoethyl ester, monohydrochloride, (2S-cis)- (9CI) (MF1)
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2006). NSC149583. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/115285
Identifiers
NSC149583
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/115285
IUPAC Chemical Identifier (IChI): C33H32N2O12,1H3-28H-32H(42H)30H(34H2)12H2-31H(46-28)47-29H-13H2-33(43H,18(36)11H2-45-27(39)14-5H-4H-8H-35-9H-14)10H2-17-22(29)26(41H)21-20(25(17)40H)23(37)15-6H-3H-7H-16(44-2H3)19(15)24(21)38
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C33H32N2O12/c1-14-27(37)18(34)9-22(46-14)47-20-11-33(43,21(36)13-45-32(42)15-5-4-8-35-12-15)10-17-24(20)31(41)26-25(29(17)39)28(38)16-6-3-7-19(44-2)23(16)30(26)40/h3-8,12,14,18,20,22,27,37,39,41,43H,9-11,13,34H2,1-2H3/t14-,18-,20+,22+,27+,33+/m1/s1
IUPAC/NIST Chemical Identifier Key (INChI): XNPXCAQTDHPAQC-NZKUBZTPSA-N