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(Q82266167)
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CTK1B9185
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(4-methoxyphenyl)-1,5-dimethylpyrrolidine-3,4-diol
1 reference
based on heuristic
inferred from SMILES
mass
237.136493468
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2S,3S,4R,5S)-2-(4-methoxyphenyl)-1,5-dimethylpyrrolidine-3,4-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₉NO₃
0 references
canonical SMILES
OC1C(O)C(N(C)C1C2=CC=C(OC)C=C2)C
0 references
isomeric SMILES
C[C@@H]1[C@H]([C@@H]([C@H](N1C)C2=CC=C(C=C2)OC)O)O
0 references
found in taxon
Codonopsis clematidea
2 references
stated in
Chemical composition ofCodonopsis clematidea grownin vitro
stated in
Alkaloid content ofCodonopsis clematidea
Identifiers
InChI
InChI=1S/C13H19NO3/c1-8-12(15)13(16)11(14(8)2)9-4-6-10(17-3)7-5-9/h4-8,11-13,15-16H,1-3H3/t8-,11-,12-,13-/m1/s1
0 references
InChIKey
GJZNAEFHIYPPEM-HUXSOILUSA-N
0 references
CAS Registry Number
32490-07-6
0 references
PubChem CID
10889945
1 reference
matched by identifier from
InChIKey
InChIKey
GJZNAEFHIYPPEM-HUXSOILUSA-N
UniChem compound ID
33432222
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90447309
1 reference
matched by identifier from
InChIKey
InChIKey
GJZNAEFHIYPPEM-HUXSOILUSA-N
DSSTOX compound identifier
DTXCID40398130
0 references
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