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(Q105325909)
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English
2-O-Galloyl-D-galacto-hexaric acid 1-methyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
1-Methyl 2-galloylgalactarate
1 reference
based on heuristic
inferred from SMILES
mass
376.064175952
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₆O₁₂
0 references
canonical SMILES
O=C(O)C(O)C(O)C(O)C(OC(=O)C1=CC(O)=C(O)C(O)=C1)C(=O)OC
0 references
isomeric SMILES
COC(=O)[C@H](OC(=O)c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O
0 references
found in taxon
Phyllanthus emblica
1 reference
stated in
New phenolic constituents from the fruit juice of Phyllanthus emblica
Identifiers
InChI
InChI=1S/C14H16O12/c1-25-14(24)11(9(19)8(18)10(20)12(21)22)26-13(23)4-2-5(15)7(17)6(16)3-4/h2-3,8-11,15-20H,1H3,(H,21,22)/t8-,9+,10+,11-/m1/s1
0 references
InChIKey
XDMSDABSDRMKOO-VPOLOUISSA-N
0 references
PubChem CID
44632502
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XDMSDABSDRMKOO-VPOLOUISSA-N
UniChem compound ID
33059118
1 reference
stated in
UniChem
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