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(Q105134209)
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English
Methyl 1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
group of stereoisomers with the chemical formula C₂₃H₃₄O₁₅
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Statements
instance of
group of stereoisomers
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subclass of
iridoid
1 reference
inferred from
iridoid
mass
550.1897703879997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₃₄O₁₅
0 references
canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C4C(=CCC14)CO
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Identifiers
InChI
InChI=1S/C23H34O15/c1-33-20(32)10-7-34-21(13-8(4-24)2-3-9(10)13)38-23-18(31)16(29)19(12(6-26)36-23)37-22-17(30)15(28)14(27)11(5-25)35-22/h2,7,9,11-19,21-31H,3-6H2,1H3
0 references
InChIKey
JRYVBZDSFXDJAN-UHFFFAOYSA-N
0 references
PubChem CID
73063764
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JRYVBZDSFXDJAN-UHFFFAOYSA-N
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