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(Q82064327)
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English
8-Trichloromethyldihydroberberine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
453.030141096
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₁₈Cl₃NO₄
0 references
canonical SMILES
ClC(Cl)(Cl)C1C=2C(OC)=C(OC)C=CC2C=C3C4=CC=5OCOC5C=C4CCN31
0 references
found in taxon
Berberis oblonga
2 references
stated in
Berberis Alkaloids XXXVIII. Turcamine ? A new isoquinoline alkaloid fromBerberis turcomanica
stated in
BerberisAlkaloids. XLI. Alkaloids from Leaves of CultivatedBerberis oblonga
Berberis integerrima
1 reference
stated in
BerberisAlkaloids. XLI. Alkaloids from Leaves of CultivatedBerberis oblonga
Identifiers
InChI
InChI=1S/C21H18Cl3NO4/c1-26-15-4-3-12-7-14-13-9-17-16(28-10-29-17)8-11(13)5-6-25(14)20(21(22,23)24)18(12)19(15)27-2/h3-4,7-9,20H,5-6,10H2,1-2H3
0 references
InChIKey
CAGHPRDTHLKFCW-UHFFFAOYSA-N
0 references
CAS Registry Number
50932-22-4
0 references
PubChem CID
320713
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
CAGHPRDTHLKFCW-UHFFFAOYSA-N
UniChem compound ID
9438
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80313347
1 reference
matched by identifier from
InChIKey
InChIKey
CAGHPRDTHLKFCW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30264471
0 references
NSC number
269192
0 references
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