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(Q90508511)
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English
1,3-Oxathiolane-2-carboxylic acid, 5-(4-amino-2-oxo-1(2H)-pyrimidinyl)-, (2R,5S)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
243.031376768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
cis-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolane-2-carboxylic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₈H₉N₃O₄S
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canonical SMILES
N=c1ccn(C2CSC(C(=O)O)O2)c(O)n1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N=c1ccn([C@@H]2CS[C@H](C(=O)O)O2)c(O)n1
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
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Identifiers
InChI
InChI=1S/C8H9N3O4S/c9-4-1-2-11(8(14)10-4)5-3-16-7(15-5)6(12)13/h1-2,5,7H,3H2,(H,12,13)(H2,9,10,14)/t5-,7+/m0/s1
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InChIKey
PIIRVEZNDVLYQA-CAHLUQPWSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
173829-09-9
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PubChem CID
15462288
1 reference
matched by identifier from
InChIKey
InChIKey
PIIRVEZNDVLYQA-CAHLUQPWSA-N
UNII
SGC57V0D26
1 reference
matched by identifier from
InChIKey
InChIKey
PIIRVEZNDVLYQA-CAHLUQPWSA-N
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