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(Q105386000)
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English
Aloesol
group of stereoisomers with the chemical formula C₁₃H₁₄O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic chromone
1 reference
inferred from
biogenic chromone
mass
234.089208928
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₄O₄
0 references
canonical SMILES
O=C1C=C(OC2=CC(O)=CC(=C12)C)CC(O)C
0 references
found in taxon
Rheum
1 reference
stated in
Studies on rhubarb (rhei rhizoma). V. Isolation and characterization of chromone and chromanone derivatives.
Identifiers
InChI
InChI=1S/C13H14O4/c1-7-3-9(15)5-12-13(7)11(16)6-10(17-12)4-8(2)14/h3,5-6,8,14-15H,4H2,1-2H3
0 references
InChIKey
ZYCNQWOKCMJKEZ-UHFFFAOYSA-N
0 references
PubChem CID
5318230
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
174202
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H14O4/c1-7-3-9(15)5-12-13(7)11(16)6-10(17-12)4-8(2)14/h3,5-6,8,14-15H,4H2,1-2H3
UniChem compound ID
32001319
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0035712
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZYCNQWOKCMJKEZ-UHFFFAOYSA-N
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