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(Q105237547)
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English
3-[3,5-Dihydroxy-4-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
group of stereoisomers with the chemical formula C₂₁H₂₀O₁₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
depside
1 reference
inferred from
depside
mass
496.08530532
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₀O₁₄
0 references
canonical SMILES
O=C(O)C1(O)CC(O)C(O)C(OC(=O)C2=CC(O)=C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O)=C2)C1
0 references
found in taxon
Mycoacia fuscoatra
1 reference
stated in
Gallotannins and related polyphenols from Pistacia weinmannifolia
Identifiers
InChI
InChI=1S/C21H20O14/c22-9-1-7(2-10(23)15(9)27)19(30)35-17-11(24)3-8(4-12(17)25)18(29)34-14-6-21(33,20(31)32)5-13(26)16(14)28/h1-4,13-14,16,22-28,33H,5-6H2,(H,31,32)
0 references
InChIKey
RJKAPNLVYLSPGX-UHFFFAOYSA-N
0 references
PubChem CID
73036706
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RJKAPNLVYLSPGX-UHFFFAOYSA-N
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