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(Q105164012)
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English
methyl (2S,12bS)-2-(5-oxo-2H-furan-4-yl)-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
methyl 2-(5-oxo-2H-furan-4-yl)-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
364.14230712
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₀N₂O₄
0 references
canonical SMILES
O=C(OC)C1=CN2CCC=3C=4C=CC=CC4NC3C2CC1C5=CCOC5=O
0 references
isomeric SMILES
COC(=O)C1=CN2CCc3c([nH]c4ccccc34)[C@@H]2C[C@H]1C1=CCOC1=O
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found in taxon
Psychotria dichroa
2 references
stated in
Alkaloids from Cephaelis dichroa
stated in
Quinoline alkaloids from Psychotria glomerulata
Palicourea dichroa
2 references
stated in
Quinoline alkaloids from Psychotria glomerulata
stated in
Alkaloids from Cephaelis dichroa
Identifiers
InChI
InChI=1S/C21H20N2O4/c1-26-20(24)16-11-23-8-6-13-12-4-2-3-5-17(12)22-19(13)18(23)10-15(16)14-7-9-27-21(14)25/h2-5,7,11,15,18,22H,6,8-10H2,1H3/t15-,18-/m0/s1
0 references
InChIKey
MHRCICBXWGKYFB-YJBOKZPZSA-N
0 references
CAS Registry Number
5545-94-8
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
163194074
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MHRCICBXWGKYFB-YJBOKZPZSA-N
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