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Dolaconine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
aconitane alkaloid
0 references
mass
419.267173284
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₇NO₅
0 references
canonical SMILES
O=C(OC1C2CC3C1C(O)(CC2OC)C4CC5C6CN(CC)C4C53C(OC)CC6)C
0 references
found in taxon
Aconitum contortum
1 reference
stated in
Studies on the Alkaloids from Aconitum contortum (I)
Aconitum episcopale
1 reference
stated in
Bisnorditerpene, Norditerpene, and Lipo-alkaloids fromAconitum toxicum
Aconitum fischeri
1 reference
stated in
THE ALKALOIDS OF ACONITUM NAPELLUS.
Identifiers
InChI
InChI=1S/C24H37NO5/c1-5-25-11-13-6-7-19(29-4)24-15(13)9-17(22(24)25)23(27)10-18(28-3)14-8-16(24)20(23)21(14)30-12(2)26/h13-22,27H,5-11H2,1-4H3
0 references
InChIKey
MLYKFKUTKJPICF-UHFFFAOYSA-N
0 references
CAS Registry Number
82841-75-6
0 references
PubChem CID
158221
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MLYKFKUTKJPICF-UHFFFAOYSA-N
UniChem compound ID
47890658
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID301002945
1 reference
matched by identifier from
InChIKey
InChIKey
MLYKFKUTKJPICF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401429873
0 references
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