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(Q83033484)
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English
1,3-Oxathiolane-2-methanol, 5-(6-amino-9H-purin-9-yl)-, (2S-trans)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
253.063345592
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
1,3-Oxathiolane-2-methanol, 5-(6-amino-9H-purin-9-yl)-, (2S-cis)-
1 reference
based on heuristic
inferred from InChI
1,3-Oxathiolane-2-methanol, 5-(6-amino-9H-purin-9-yl)-, (2R-cis)-
1 reference
based on heuristic
inferred from InChI
1,3-Oxathiolane-2-methanol, 5-(6-amino-9H-purin-9-yl)-, (2R-trans)-
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₁N₅O₂S
0 references
canonical SMILES
Nc1ncnc2c1ncn2C1CSC(CO)O1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1[C@H](O[C@@H](S1)CO)N2C=NC3=C(N=CN=C32)N
0 references
Identifiers
InChI
InChI=1S/C9H11N5O2S/c10-8-7-9(12-3-11-8)14(4-13-7)5-2-17-6(1-15)16-5/h3-6,15H,1-2H2,(H2,10,11,12)/t5-,6-/m0/s1
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InChIKey
GOIOKJULSNLSBB-WDSKDSINSA-N
0 references
CAS Registry Number
149819-62-5
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PubChem CID
11230529
1 reference
matched by identifier from
InChIKey
InChIKey
GOIOKJULSNLSBB-WDSKDSINSA-N
UniChem compound ID
364068
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90164403
1 reference
matched by identifier from
InChIKey
InChIKey
GOIOKJULSNLSBB-WDSKDSINSA-N
DSSTOX compound identifier
DTXCID0086894
0 references
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