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(Q105297686)
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Retulinal
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8-acetyl-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
336.183778008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₄N₂O₂
0 references
canonical SMILES
O=CC1C2C(=CC)CN3CCC4(C=5C=CC=CC5N(C(=O)C)C14)C3C2
0 references
isomeric SMILES
C/C=C1/CN2CC[C@]34c5ccccc5N(C(C)=O)[C@H]3[C@@H](C=O)[C@H]1C[C@H]24
0 references
found in taxon
Strychnos kasengaensis
1 reference
stated in
Dehydroisostrychnobiline, matopensine and other alkaloids from Strychnos kasengaensis
Strychnos variabilis
1 reference
stated in
New indole aldehydic alkaloids of strychnos variabilis
Identifiers
InChI
InChI=1S/C21H24N2O2/c1-3-14-11-22-9-8-21-17-6-4-5-7-18(17)23(13(2)25)20(21)16(12-24)15(14)10-19(21)22/h3-7,12,15-16,19-20H,8-11H2,1-2H3/b14-3-/t15-,16-,19-,20-,21+/m0/s1
0 references
InChIKey
VVJAXIGCVFZTKR-SEACFGBCSA-N
0 references
PubChem CID
21763838
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VVJAXIGCVFZTKR-SEACFGBCSA-N
UniChem compound ID
57422081
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID401339220
1 reference
matched by identifier from
InChIKey
InChIKey
VVJAXIGCVFZTKR-SEACFGBCSA-N
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