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Caffeoyl-l-malic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid
1 reference
based on heuristic
inferred from SMILES
mass
296.053217344
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₂O₈
0 references
canonical SMILES
O=C(O)CC(O)(C(=O)O)C(=O)C=CC1=CC=C(O)C(O)=C1
0 references
isomeric SMILES
O=C(O)C[C@](O)(C(=O)O)C(=O)/C=C/c1ccc(O)c(O)c1
0 references
found in taxon
Ballota nigra
2 references
stated in
Phenylpropanoids from Ballota nigra L. inhibit in vitro LDL peroxidation
stated in
Neurosedative and antioxidant activities of phenylpropanoids from ballota nigra
Marrubium vulgare
1 reference
stated in
Isolation and pharmacological activity of phenylpropanoid esters from Marrubium vulgare
Chelidonium majus
1 reference
stated in
Hydroxycinnamic Acid Derivatives, Caffeoylmalic and New Caffeoylaldonic Acid Esters, from Chelidonium majus*,1.
Identifiers
InChI
InChI=1S/C13H12O8/c14-8-3-1-7(5-9(8)15)2-4-10(16)13(21,12(19)20)6-11(17)18/h1-5,14-15,21H,6H2,(H,17,18)(H,19,20)/b4-2+/t13-/m1/s1
0 references
InChIKey
NHYPUVOSYZUDMG-CXLRFSCWSA-N
0 references
PubChem CID
129821613
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NHYPUVOSYZUDMG-CXLRFSCWSA-N
UniChem compound ID
161843923
1 reference
stated in
UniChem
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