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(Q105103328)
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English
(7S,12aR)-3,10-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,9-diol
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
Litcubine
1 reference
based on heuristic
inferred from SMILES
(12aR)-3,10-dimethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium-2,9-diol
1 reference
based on heuristic
inferred from SMILES
mass
328.15433460409
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₂NO₄⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
OC=1C=C2C(=CC1OC)CC[N+]3(C4=CC(O)=C(OC)C=C4CC23)C
0 references
isomeric SMILES
COc1cc2c(cc1O)[C@H]1Cc3cc(OC)c(O)cc3[N@@+]1(C)CC2
0 references
found in taxon
Litsea cubeba
1 reference
stated in
Two Dibenzopyrrocoline Alkaloids fromLitsea cubeba
Xylopia holtzii
1 reference
stated in
Quaternary isoquinoline alkaloids from Xylopia parviflora
Identifiers
InChI
InChI=1S/C19H21NO4/c1-20-5-4-11-7-18(23-2)16(21)9-13(11)15(20)6-12-8-19(24-3)17(22)10-14(12)20/h7-10,15H,4-6H2,1-3H3,(H-,21,22)/p+1/t15-,20-/m1/s1
0 references
InChIKey
CWKRVCVOEADAEH-FOIQADDNSA-O
0 references
PubChem CID
163195212
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CWKRVCVOEADAEH-FOIQADDNSA-O
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