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(Q105035634)
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English
(8-Acetyl-8-azabicyclo[3.2.1]octan-3-yl) 3,4-dimethoxybenzoate
group of stereoisomers with the chemical formula C₁₈H₂₃NO₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
tropane alkaloids
1 reference
inferred from
tropane alkaloids
mass
333.157622836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₃NO₅
0 references
canonical SMILES
O=C(OC1CC2N(C(=O)C)C(CC2)C1)C3=CC=C(OC)C(OC)=C3
0 references
found in taxon
Convolvulus subhirsutus
1 reference
stated in
Tropane alkaloids of two species of plants of theConvolvulus genus
Identifiers
InChI
InChI=1S/C18H23NO5/c1-11(20)19-13-5-6-14(19)10-15(9-13)24-18(21)12-4-7-16(22-2)17(8-12)23-3/h4,7-8,13-15H,5-6,9-10H2,1-3H3
0 references
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
0 references
PubChem CID
3788763
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
UniChem compound ID
22875221
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN_NPDepo-CB000054
1 reference
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA02061
1 reference
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA02062
1 reference
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA02063
1 reference
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_NPDepo-NGA02064
1 reference
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
DSSTox substance ID
DTXSID501345715
1 reference
matched by identifier from
InChIKey
InChIKey
HZEOENYXYFFKIU-UHFFFAOYSA-N
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