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Structure

POLYCYTIDYLIC ACID (5') POTASSIUM SALT

CAS
26936-40-3
Catalog Number
ACM26936403
Category
Other Products
Molecular Weight
399.38g/mol
Molecular Formula
C9H12K2N3O8P

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Specification

IUPAC Name
dipotassium;[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
Canonical SMILES
C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)([O-])[O-])O)O.[K+].[K+]
InChI
InChI=1S/C9H14N3O8P.2K/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18);;/q;2*+1/p-2
InChI Key
KJFHSFLOUJGHLS-UHFFFAOYSA-L
Complexity
520
Covalently-Bonded Unit Count
3
Exact Mass
398.963614g/mol
Formal Charge
0
H-Bond Acceptor
8
H-Bond Donor
3
Heavy Atom Count
23
Monoisotopic Mass
398.963614g/mol
Rotatable Bond Count
3
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