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Structure

Cgs 21680c sodium salt

CAS
120225-64-1
Catalog Number
ACM120225641
Category
Other Products
Molecular Weight
521.50
Molecular Formula
C23H28N7NaO6

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Specification

Synonyms
CGS 21680C, CID3086598, 120225-64-1, Benzenepropanoic acid, 4-(2-((6-amino-9-(N-ethyl-beta-D-ribofuranuronamidosyl)-9H-purin-2-yl)amino)ethyl)-, monosodium salt
IUPAC Name
sodium 3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid
Canonical SMILES
CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)NCCC4=CC=C(C=C4)CCC(=O)[O-])O)O.[Na+]
InChI Key
NRYCRDCUHXETEK-MJWSIIAUSA-N
H-Bond Acceptor
11
H-Bond Donor
6
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