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(Q72497854)
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Onitin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
illudalane sesquiterpenoid
0 references
mass
248.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₀O₃
0 references
canonical SMILES
CC1=C(C(=C(C2=C1C(=O)C(C2)(C)C)O)C)CCO
0 references
found in taxon
Onychium siliculosum
3 references
stated in
Studies on the Taiwan folk medicine; III. A smooth muscle relaxant from Onychium siliculosum, onitin
stated in
Studies on the Taiwan folk medicine. VI. Studies on onitin
stated in
Flavanone and other constituents from Onychium siliculosum
Dicksonia gigantea
1 reference
stated in
Chemical and chemotaxonomical studies on filices. LI. Chemical studies on the constituents of Costa Rican ferns. 3.
Dicksonia karsteniana
1 reference
stated in
Chemical and chemotaxonomical studies on filices. LI. Chemical studies on the constituents of Costa Rican ferns. 3.
Dicksonia sellowiana
1 reference
stated in
Chemical and chemotaxonomical studies on filices. LI. Chemical studies on the constituents of Costa Rican ferns. 3.
Equisetum arvense
1 reference
stated in
The flavonoids of Equisetum ramosissimum
Phomopsis
1 reference
stated in
Protoilludane, Illudalane, and Botryane Sesquiterpenoids from the Endophytic Fungus Phomopsis sp. TJ507A
Identifiers
InChI
InChI=1S/C15H20O3/c1-8-10(5-6-16)9(2)13(17)11-7-15(3,4)14(18)12(8)11/h16-17H,5-7H2,1-4H3
0 references
InChIKey
IWRJCMQFEMXOML-UHFFFAOYSA-N
0 references
CAS Registry Number
53823-02-2
0 references
PubChem CID
3085044
1 reference
matched by identifier from
InChIKey
InChIKey
IWRJCMQFEMXOML-UHFFFAOYSA-N
ChEBI ID
196151
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H20O3/c1-8-10(5-6-16)9(2)13(17)11-7-15(3,4)14(18)12(8)11/h16-17H,5-7H2,1-4H3
UniChem compound ID
445225
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20202105
1 reference
matched by identifier from
InChIKey
InChIKey
IWRJCMQFEMXOML-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80124596
0 references
KNApSAcK ID
C00021490
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IWRJCMQFEMXOML-UHFFFAOYSA-N
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