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5'-Thymidylic acid calcium salt(3372-09-6) IR1
Product Name5'-Thymidylic acid calcium salt
CAS3372-09-6
Molecular FormulaC10H13CaN2O8P
Molecular Weight360.27
InChIInChI=1/C10H15N2O8P.Ca/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(20-8)4-19-21(16,17)18;/h3,6-8,13H,2,4H2,1H3,(H,11,14,15)(H2,16,17,18);/q;+2/p-2/t6-,7+,8+;/s3
InChIKey BIFTVWGSQNJZPP-JEBNKXSCNA-L
Smiles[C@@H]1(C[C@H](O)[C@@H](COP([O-])([O-])=O)O1)N1C=C(C(=O)NC1=O)C.[Ca+2] |&1:0,2,4,r|
