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Structure

Adenosine 5'-[hydrogen[[hydroxy(phosphonooxy)phosphinyl]methyl]phosphonate]

CAS
7292-42-4
Catalog Number
ACM7292424
Category
Other Products
Molecular Weight
C11H15N5Na3O12P3
Molecular Formula
C11H18N5O12P3

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Specification

Synonyms
Adenosine 5'-[hydrogen [[hydroxy(phosphonooxy)phosphinyl]methyl]phosphonate];alpha,beta-Methyleneadenosine 5'-triphosphate trisodium salt
IUPAC Name
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[hydroxy(phosphonooxy)phosphoryl]methyl]phosphinic acid
Canonical SMILES
C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(CP(=O)(O)OP(=O)(O)O)O)O)O
InChI Key
CAWZRIXWFRFUQB-IOSLPCCCSA-N
Boiling Point
968.2ºC at 760 mmHg
Flash Point
539.3ºC
Density
2.5g/cm³
EC Number
230-723-9
Exact Mass
505.01600
H-Bond Acceptor
16
H-Bond Donor
7
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