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(Q69999894)
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English
glucovanillin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
314.100167536
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₈O₈
0 references
canonical SMILES
O=Cc2ccc(OC1OC(CO)C(O)C(O)C1O)c(OC)c2
0 references
Identifiers
InChI
InChI=1S/C14H18O8/c1-20-9-4-7(5-15)2-3-8(9)21-14-13(19)12(18)11(17)10(6-16)22-14/h2-5,10-14,16-19H,6H2,1H3
0 references
InChIKey
LPRNQMUKVDHCFX-UHFFFAOYSA-N
0 references
PubChem CID
3648225
1 reference
matched by identifier from
InChIKey
InChIKey
LPRNQMUKVDHCFX-UHFFFAOYSA-N
ChEBI ID
168797
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C14H18O8/c1-20-9-4-7(5-15)2-3-8(9)21-14-13(19)12(18)11(17)10(6-16)22-14/h2-5,10-14,16-19H,6H2,1H3
UniChem compound ID
24412545
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0029664
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LPRNQMUKVDHCFX-UHFFFAOYSA-N
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