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(Q82894783)
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English
3-(6-Amino-9H-purin-9-yl)-4-fluoro-5-(hydroxymethyl)cyclopentane-1,2-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
283.108067528
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₁H₁₄FN₅O₃
0 references
canonical SMILES
Nc1ncnc2c1ncn2C1C(O)C(O)C(CO)C1F
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=NC(=C2C(=N1)N(C=N2)[C@@H]3[C@H]([C@H]([C@@H]([C@@H]3F)CO)O)O)N
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Identifiers
InChI
InChI=1S/C11H14FN5O3/c12-5-4(1-18)8(19)9(20)7(5)17-3-16-6-10(13)14-2-15-11(6)17/h2-5,7-9,18-20H,1H2,(H2,13,14,15)/t4-,5+,7+,8+,9-/m1/s1
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InChIKey
LFSGVDMIBZBPPJ-JKBCRHRPSA-N
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CAS Registry Number
115509-32-5
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PubChem CID
189917
1 reference
matched by identifier from
InChIKey
InChIKey
LFSGVDMIBZBPPJ-JKBCRHRPSA-N
UniChem compound ID
64738348
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60921747
1 reference
matched by identifier from
InChIKey
InChIKey
LFSGVDMIBZBPPJ-JKBCRHRPSA-N
DSSTOX compound identifier
DTXCID901350637
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