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67013-98-3 , Cytarazid, CAS:67013-98-3

67013-98-3 , Cytarazid,
CAS:67013-98-3
C9H12N6O4 / 268.229

Cytarazid, 2-叠氮-D-阿糖胞苷

CAS Number67013-98-3
Product NameCytarazid
IUPAC Name4-amino-1-[(2R,3S,4S,5R)-3-azido-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Molecular FormulaC9H12N6O4
Molecular Weight268.229 g/mol
InChIInChI=1S/C9H12N6O4/c10-5-1-2-15(9(18)12-5)8-6(13-14-11)7(17)4(3-16)19-8/h1-2,4,6-8,16-17H,3H2,(H2,10,12,18)/t4-,6+,7-,8-/m1/s1
InChI KeyFEOYKPQEERVCAV-PXBUCIJWSA-N
SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)N=[N+]=[N-]
Synonymscytarazid
Canonical SMILESC1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)N=[N+]=[N-]
Isomeric SMILESC1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)N=[N+]=[N-]


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