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(Q105214385)
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English
Methyl 11-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,10,12-trioxatricyclo[7.2.1.02,7]dodec-5-ene-6-carboxylate
group of stereoisomers with the chemical formula C₁₇H₂₄O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
secoiridoid monoterpenoid
1 reference
inferred from
secoiridoid monoterpenoid
mass
420.126776208
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₄O₁₂
0 references
canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C4OC(OC4O)CC13
0 references
found in taxon
Galium album
1 reference
stated in
Iridoids from Galium mollugo
Identifiers
InChI
InChI=1S/C17H24O12/c1-24-14(22)6-4-25-16(9-5(6)2-8-27-13(9)15(23)28-8)29-17-12(21)11(20)10(19)7(3-18)26-17/h4-5,7-13,15-21,23H,2-3H2,1H3
0 references
InChIKey
PSTHWEAXBIXPRZ-UHFFFAOYSA-N
0 references
PubChem CID
4490615
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PSTHWEAXBIXPRZ-UHFFFAOYSA-N
UniChem compound ID
48318950
1 reference
stated in
UniChem
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