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(Q82947470)
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English
Trachelanthine
group of stereoisomers with the chemical formula C₁₅H₂₇NO₅
In more languages
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Statements
instance of
group of stereoisomers
0 references
subclass of
pyrrolizidine alkaloid
1 reference
inferred from
pyrrolizidine alkaloid
mass
301.188922964
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₇NO₅
0 references
canonical SMILES
O=C(OCC1CC[N+]2([O-])CCCC12)C(O)(C(O)C)C(C)C
0 references
isomeric SMILES
CC(C)[C@](O)(C(=O)OC[C@H]1CC[N+]2([O-])CCC[C@@H]12)C(C)O
0 references
found in taxon
Trachelanthus korolkowii
1 reference
stated in
An investigation of the alkaloid content of some Central Asian plants
Identifiers
InChI
InChI=1S/C15H27NO5/c1-10(2)15(19,11(3)17)14(18)21-9-12-6-8-16(20)7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11?,12-,13+,15-,16?/m1/s1
0 references
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
0 references
CAS Registry Number
510-19-0
0 references
PubChem CID
10523
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
45995558
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR300546
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300551
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300555
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300560
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300564
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300569
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300574
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300578
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300582
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300587
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300592
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR300596
1 reference
InChIKey
DLNWZIVYKQXLTN-CGYUPCHJSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
DSSTox substance ID
DTXSID90965275
0 references
DSSTOX compound identifier
DTXCID001392947
0 references
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