New
Capecitabine
Standard
CAS#[154361-50-9]
G-codeGEO-04908
Molecular formulaC15H22FN3O6
Molecular weight359.35
Synonyms N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyl-2-oxolanyl]-5-fluoro-2-oxo-4-pyrimidinyl]carbamic acid pentyl ester
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Structural identification
CAS#[154361-50-9]
G-codeGEO-04908
SMILESCCCCCOC(=O)NC1=NC(=O)N(C=C1F)[C@H]2[C@@H]([C@@H]([C@H](O2)C)O)O
InChIInChI=1S/C15H22FN3O6/c1-3-4-5-6-24-15(23)18-12-9(16)7-19(14(22)17-12)13-11(21)10(20)8(2)25-13/h7-8,10-11,13,20-21H,3-6H2,1-2H3,(H,17,18,22,23)/t8-,10-,11-,13-/m1/s1
InChI KeyInChIKey=GAGWJHPBXLXJQN-UORFTKCHSA-N
Regulatory Information
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