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(Q104992045)
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English
Annuionone C
group of stereoisomers with the chemical formula C₁₃H₂₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
megastigmane
1 reference
inferred from
megastigmane
mass
224.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₀O₃
0 references
canonical SMILES
O=C1CC2(OC2(C=CC(O)C)C(C)(C)C1)C
0 references
isomeric SMILES
CC(O)/C=C/C12OC1(C)CC(=O)CC2(C)C
1 reference
based on heuristic
inferred from InChI
found in taxon
common sunflower
2 references
stated in
Bioactive norsesquiterpenes from Helianthus annuus with potential allelopathic activity
stated in
Bioactive apocarotenoids annuionones F and G: structural revision of annuionones A, B and E
Identifiers
InChI
InChI=1S/C13H20O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,9,14H,7-8H2,1-4H3/b6-5+
0 references
InChIKey
DZVNWYFIADDOQC-AATRIKPKSA-N
0 references
PubChem CID
9920924
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DZVNWYFIADDOQC-AATRIKPKSA-N
ChEBI ID
168292
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H20O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,9,14H,7-8H2,1-4H3/b6-5+
UniChem compound ID
32007878
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0032689
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DZVNWYFIADDOQC-AATRIKPKSA-N
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