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(Q72509208)
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English
Toddaline
chemical compound
(+)-Toddalolactone
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
308.12598836
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(S)-6-(2,3-Dihydroxy-3-methylbutyl)-5,7-dimethoxy-2H-chromen-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₀O₆
0 references
canonical SMILES
O=C1OC2=CC(OC)=C(C(OC)=C2C=C1)CC(O)C(O)(C)C
0 references
isomeric SMILES
CC(C)([C@@H](CC1=C(C=C2C(=C1OC)C=CC(=O)O2)OC)O)O
0 references
found in taxon
Toddalia asiatica
3 references
stated in
Anti-platelet aggregation constituents from Formosan Toddalia asiatica
stated in
Studies on the Chemical Constituents of Rutaceous Plants. LXVI. The Chemical Constituents of Toddalia asiatica (L.) LAM. (T. aculeata PERS.). (1). Chemical Constituents of the Root Bark
stated in
Toddaquinoline from formosan Toddalia asiatica
Zanthoxylum asiaticum
3 references
stated in
Anti-platelet aggregation constituents from Formosan Toddalia asiatica
stated in
Studies on the Chemical Constituents of Rutaceous Plants. LXVI. The Chemical Constituents of Toddalia asiatica (L.) LAM. (T. aculeata PERS.). (1). Chemical Constituents of the Root Bark
stated in
Toddaquinoline from formosan Toddalia asiatica
Identifiers
InChI
InChI=1S/C16H20O6/c1-16(2,19)13(17)7-10-11(20-3)8-12-9(15(10)21-4)5-6-14(18)22-12/h5-6,8,13,17,19H,7H2,1-4H3/t13-/m1/s1
0 references
InChIKey
GLWPLQBQHWYKRK-CYBMUJFWSA-N
0 references
CAS Registry Number
483-90-9
1 reference
InChIKey
GLWPLQBQHWYKRK-CYBMUJFWSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=483-90-9
PubChem CID
160485
1 reference
matched by identifier from
InChIKey
InChIKey
GLWPLQBQHWYKRK-CYBMUJFWSA-N
ChEBI ID
228914
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H20O6/c1-16(2,19)13(17)7-10-11(20-3)8-12-9(15(10)21-4)5-6-14(18)22-12/h5-6,8,13,17,19H,7H2,1-4H3/t13-/m1/s1
UniChem compound ID
5899110
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00197484
1 reference
matched by identifier from
InChIKey
InChIKey
GLWPLQBQHWYKRK-CYBMUJFWSA-N
DSSTOX compound identifier
DTXCID10119975
0 references
Probes And Drugs ID
PD087918
0 references
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