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(Q104252151)
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Isopaynantheine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
Methyl 9,17-dimethoxycoryna-16,18-dien-16-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
396.204907376
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Paynantheine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
methyl (Z)-2-[(2R,3S,12bR)-3-ethenyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
1 reference
based on heuristic
inferred from InChIKey
chemical formula
C₂₃H₂₈N₂O₄
0 references
canonical SMILES
O=C(OC)C(=COC)C1CC2C=3NC=4C=CC=C(OC)C4C3CCN2CC1C=C
0 references
isomeric SMILES
C=C[C@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC
0 references
found in taxon
Mitragyna hirsuta
1 reference
stated in
The Chemotaxonomic Significance of Alkaloids in the Naucleeae S.L. (Rubiaceae)
Mitragyna speciosa
1 reference
stated in
The Mitragyna Species of Asia
Identifiers
InChI
InChI=1S/C23H28N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h5-8,13-14,16,19,24H,1,9-12H2,2-4H3/b17-13+/t14-,16-,19+/m0/s1
0 references
InChIKey
JGZKIGWXPPFMRG-CGJCNEAHSA-N
0 references
PubChem CID
101804033
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
101151963
1 reference
stated in
UniChem
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