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(Q105272010)
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English
2-(4-hydroxyphenyl)ethyl 5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
group of stereoisomers with the chemical formula C₂₅H₃₂O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
secoiridoid monoterpenoid
1 reference
inferred from
secoiridoid monoterpenoid
mass
524.189376464
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₂O₁₂
0 references
canonical SMILES
O=C(OCCC1=CC=C(O)C=C1)C2=COC(OC3OC(CO)C(O)C(O)C3O)C(=CC)C2CC(=O)OC
0 references
found in taxon
Syringa vulgaris
1 reference
stated in
Secoiridoid and iridoid glucosides from Syringa afghanica
Identifiers
InChI
InChI=1S/C25H32O12/c1-3-15-16(10-19(28)33-2)17(23(32)34-9-8-13-4-6-14(27)7-5-13)12-35-24(15)37-25-22(31)21(30)20(29)18(11-26)36-25/h3-7,12,16,18,20-22,24-27,29-31H,8-11H2,1-2H3
0 references
InChIKey
UFOVAZLPOLBVGA-UHFFFAOYSA-N
0 references
PubChem CID
78410311
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UFOVAZLPOLBVGA-UHFFFAOYSA-N
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