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English
(3aR,4R,7aR)-4-(Hydroxymethyl)-6-methoxytetrahydro-4H-furo[3,2-c]pyran-2(3H)-one
group of stereoisomers with the chemical formula C₉H₁₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
202.084123548
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₄O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC1CC2OC(=O)CC2C(CO)O1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC1C[C@H]2OC(=O)C[C@H]2[C@H](CO)O1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H14O5/c1-12-9-3-6-5(2-8(11)13-6)7(4-10)14-9/h5-7,9-10H,2-4H2,1H3/t5-,6-,7+,9?/m1/s1
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InChIKey
CEVALZNMSHYICJ-JBPTWFHOSA-N
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CAS Registry Number
62210-98-4
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PubChem CID
71311682
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
66621545
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50746648
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DSSTOX compound identifier
DTXCID40697392
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