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(Q105228666)
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Grandisine B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(1,2,3,5,6,8a-Hexahydroindolizin-8-yl)-8-methyl-2-azabicyclo[2.2.2]oct-2-en-5-one
1 reference
based on heuristic
inferred from SMILES
mass
258.173213324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₂N₂O
0 references
canonical SMILES
O=C1CC2N=C(C3=CCCN4CCCC34)C1C(C)C2
0 references
isomeric SMILES
C[C@H]1C[C@H]2CC(=O)[C@@H]1C(C1=CCCN3CCC[C@@H]13)=N2
0 references
found in taxon
Elaeocarpus grandis
2 references
stated in
Grandisines C-G, indolizidine alkaloids from the Australian rainforest tree Elaeocarpus grandis
stated in
Grandisine A and B, novel indolizidine alkaloids with human delta-opioid receptor binding affinity from the leaves of the Australian rainforest tree Elaeocarpus grandis.
Elaeocarpus angustifolius
2 references
stated in
Grandisines C-G, indolizidine alkaloids from the Australian rainforest tree Elaeocarpus grandis
stated in
Grandisine A and B, novel indolizidine alkaloids with human delta-opioid receptor binding affinity from the leaves of the Australian rainforest tree Elaeocarpus grandis.
Identifiers
InChI
InChI=1S/C16H22N2O/c1-10-8-11-9-14(19)15(10)16(17-11)12-4-2-6-18-7-3-5-13(12)18/h4,10-11,13,15H,2-3,5-9H2,1H3/t10-,11-,13-,15+/m0/s1
0 references
InChIKey
QVHSEEKPJUZQLM-TZQJONAQSA-N
0 references
PubChem CID
11402679
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QVHSEEKPJUZQLM-TZQJONAQSA-N
UniChem compound ID
34433873
1 reference
stated in
UniChem
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