Mrs 2365

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Catalog Number
ACM436847095
Product Name
Mrs 2365
CAS
436847-09-5
Category
Heterocyclic Organic Compound
Synonyms
MRS 2365, MolPort-035-765-664, AKOS024456961, [[(1R,2R,3S,4R,5S)-4-[6-Amino-2-(methylthio)-9H-purin-9-yl]-2,3-dihydroxybicyclo[3.1.0]hex-1-yl]methyl] diphosphoric acid mono ester trisodium salt, 436847-09-5
IUPAC Name
trisodium;[[(1R,2R,3S,5S)-4-(6-amino-2-methylsulfanylpurin-9-yl)-2,3-dihydroxy-1-bicyclo[3.1.0]hexanyl]methoxy-oxidophosphoryl] phosphate
Molecular Weight
549.279
Molecular Formula
C13H16N5O9P2SNa3
Canonical SMILES
CSC1=NC2=C(C(=N1)N)N=CN2C3C4CC4(C(C3O)O)COP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+]
InChI Key
ZYPJOXVKTCEBCA-PVMCGCOJSA-K
Exact Mass
548.98400
H-Bond Acceptor
14
H-Bond Donor
3
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