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Adecypenol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Adecypenol
1 reference
based on heuristic
inferred from SMILES
mass
280.117154992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆N₄O₄
0 references
canonical SMILES
OCC1=CC(N2C=NC3=C2NC=NCC3O)C(O)C1O
0 references
found in taxon
Saccharothrix
1 reference
stated in
Carbocyclic nucleosides from a species of Saccharothrix
Streptomyces
1 reference
stated in
Adecypenol, a unique adenosine deaminase inhibitor containing homopurine and cyclopentene rings. Taxonomy, production and enzyme inhibition.
Identifiers
InChI
InChI=1S/C12H16N4O4/c17-3-6-1-7(11(20)10(6)19)16-5-15-9-8(18)2-13-4-14-12(9)16/h1,4-5,7-8,10-11,17-20H,2-3H2,(H,13,14)
0 references
InChIKey
WJSAFKJWCOMTLH-UHFFFAOYSA-N
0 references
CAS Registry Number
104493-13-2
1 reference
InChIKey
WJSAFKJWCOMTLH-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=104493-13-2
PubChem CID
128589
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WJSAFKJWCOMTLH-UHFFFAOYSA-N
UniChem compound ID
26780018
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80909002
1 reference
matched by identifier from
InChIKey
InChIKey
WJSAFKJWCOMTLH-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID101338073
0 references
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