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(Q82859456)
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N6-butyladenosine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
323.159354152
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₁N₅O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCNc1ncnc2c1ncn2C1OC(CO)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H21N5O4/c1-2-3-4-15-12-9-13(17-6-16-12)19(7-18-9)14-11(22)10(21)8(5-20)23-14/h6-8,10-11,14,20-22H,2-5H2,1H3,(H,15,16,17)/t8-,10-,11-,14-/m1/s1
0 references
InChIKey
YJRFEVRDDAASMO-IDTAVKCVSA-N
0 references
PubChem CID
13506395
0 references
UniChem compound ID
695768
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60877619
0 references
DSSTOX compound identifier
DTXCID30956900
0 references
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