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(Q105156676)
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Methyl Shikimate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
188.068473484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₂O₅
0 references
canonical SMILES
O=C(OC)C1=CC(O)C(O)C(O)C1
0 references
isomeric SMILES
COC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1
0 references
found in taxon
Hydrangea macrophylla
1 reference
stated in
New Cyanoglycosides, Hydracyanosides D, E, and F, from the Leaves of Hydrangea macrophylla
Sequoiadendron giganteum
1 reference
stated in
(3S,4S,5R)-3,4,5-trihydroxy-1-cyclohexene-carboxylic acid from Sequoiadendron giganteum
Identifiers
InChI
InChI=1S/C8H12O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2,5-7,9-11H,3H2,1H3/t5-,6-,7-/m1/s1
0 references
InChIKey
LSNUUAUXWJZSFD-FSDSQADBSA-N
0 references
PubChem CID
10773951
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
SureChEMBL ID
SCHEMBL3006812
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
16074052
1 reference
stated in
UniChem
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