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(Q104393036)
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English
1,3,4-trihydroxy-5-(3,4,5-trihydroxybenzoyl)oxycyclohexane-1-carboxylic acid
group of stereoisomers with the chemical formula C₁₄H₁₆O₁₀
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
344.2714
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₆O₁₀
0 references
canonical SMILES
O=C(O)C1(O)CC(O)C(O)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1
0 references
found in taxon
Quercus aliena
1 reference
stated in
Tannins and related compounds. CIX. Isolation of alienanins A and B, novel C,C-linked ellagitannin dimers from Quercus aliena Blume.
Eriogonum umbellatum
1 reference
stated in
Metabolites of Eriogonum umbellatum
Cistus creticus
1 reference
stated in
Phytochemical analysis of the labdanum-poor Cistus creticus subsp. eriocephalus (Viv.) Greuter et Burdet growing in central Italy
Identifiers
InChI
InChI=1S/C14H16O10/c15-6-1-5(2-7(16)10(6)18)12(20)24-9-4-14(23,13(21)22)3-8(17)11(9)19/h1-2,8-9,11,15-19,23H,3-4H2,(H,21,22)
0 references
InChIKey
LDPLFHGGZNSKDS-UHFFFAOYSA-N
0 references
PubChem CID
4486613
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
LDPLFHGGZNSKDS-UHFFFAOYSA-N
UniChem compound ID
32016789
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0039287
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LDPLFHGGZNSKDS-UHFFFAOYSA-N
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