NSC149584

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Creator
US National Cancer Institute
Publication Date
2006-01-31
Alternative Title
Adriamycin octanoate
Adriamycin 14-octanoate, hydrochloride
Adriamycin, 14-octanoate, hydrochloride
Doxorubicin 14-octanoate HCl
Octanoic 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, hydrochloride, (2S-cis)- (9CI)
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2006). NSC149584. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/115286
Identifiers
NSC149584
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/115286
IUPAC Chemical Identifier (IChI): C35H43NO12,1H3-7H2-8H2-9H2-10H2-11H2-12H2-21(38)46-14H2-20(37)35(44H)13H2-19-25(31H(16H2-35)48-33H-15H2-32H(36H2)34H(43H)30H(2H3)47-33)29(42H)24-23(28(19)41H)26(39)17-5H-4H-6H-18(45-3H3)22(17)27(24)40
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C35H43NO12/c1-4-5-6-7-8-12-24(38)46-16-23(37)35(44)14-19-27(22(15-35)48-25-13-20(36)30(39)17(2)47-25)34(43)29-28(32(19)41)31(40)18-10-9-11-21(45-3)26(18)33(29)42/h9-11,17,20,22,25,30,39,41,43-44H,4-8,12-16,36H2,1-3H3/t17-,20+,22+,25+,30-,35+/m1/s1
IUPAC/NIST Chemical Identifier Key (INChI): MFUJRSZQSMPGLX-GHSPTBBOSA-N