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(Q83059710)
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3-Isoantirhine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
indolo[2,3-a]quinolizine alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
296.188863388
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2S)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]but-3-en-1-ol
1 reference
based on heuristic
inferred from InChI
Antirhine
1 reference
based on heuristic
inferred from InChI
(2R)-2-[(2R,12bS)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]but-3-en-1-ol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₄N₂O
0 references
canonical SMILES
OCC(C=C)C1CCN2CCC=3C=4C=CC=CC4NC3C2C1
0 references
isomeric SMILES
C=C[C@@H](CO)[C@H]1CCN2CCC3=C([C@H]2C1)NC4=CC=CC=C34
0 references
found in taxon
Guettarda heterosepala
1 reference
stated in
Epi-3 Antirhine, Alcaloïde nouveau Extrait de Guettarda heterosepala
Alstonia macrophylla
1 reference
stated in
Alstonia scholaris (L.) R. Br. and Alstonia macrophylla Wall. ex G. Don: A comparative review on traditional uses, phytochemistry and pharmacology
Identifiers
InChI
InChI=1S/C19H24N2O/c1-2-13(12-22)14-7-9-21-10-8-16-15-5-3-4-6-17(15)20-19(16)18(21)11-14/h2-6,13-14,18,20,22H,1,7-12H2/t13-,14-,18+/m0/s1
0 references
InChIKey
RYMNVEAAYOFGCI-SUNYJGFJSA-N
0 references
CAS Registry Number
34384-65-1
0 references
PubChem CID
5491661
1 reference
matched by identifier from
InChIKey
InChIKey
RYMNVEAAYOFGCI-SUNYJGFJSA-N
UniChem compound ID
64561280
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90187955
1 reference
matched by identifier from
InChIKey
InChIKey
RYMNVEAAYOFGCI-SUNYJGFJSA-N
DSSTOX compound identifier
DTXCID50110446
0 references
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