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(Q90531925)
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English
9H-Purin-6-amine, 9-(5-S-methyl-5-thio-β-D-xylofuranosyl)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₁₁H₁₅N₅O₃S
0 references
canonical SMILES
CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O
1 reference
based on heuristic
inferred from InChI
catalog
CAS COVID-19 Anti-Viral Candidate Compounds
0 references
Identifiers
InChI
InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)
0 references
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
53458-29-0
0 references
PubChem CID
149
1 reference
matched by identifier from
InChIKey
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
ChEBI ID
180963
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)
SureChEMBL ID
SCHEMBL890628
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
DSSTox substance ID
DTXSID70862955
1 reference
matched by identifier from
InChIKey
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0257557
1 reference
matched by identifier from
InChIKey
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
KNApSAcK ID
C00061049
1 reference
matched by identifier from
InChIKey
InChIKey
WUUGFSXJNOTRMR-UHFFFAOYSA-N
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