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(Q103816554)
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English
1-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4,7-dicarboxylic acid
group of stereoisomers with the chemical formula C₁₆H₂₀O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
iridoid
1 reference
inferred from
iridoid
mass
388.10056146
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₀O₁₁
0 references
canonical SMILES
O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C(=CCC13)C(=O)O
0 references
found in taxon
Ixora
1 reference
stated in
Two new iridoid glucosides from Ixora chinensis
Catunaregam spinosa
1 reference
stated in
An iridoid from randia dumetorum
Tarenna attenuata
1 reference
stated in
Iridoid constituents of Tarenna attenuata
Identifiers
InChI
InChI=1S/C16H20O11/c17-3-8-10(18)11(19)12(20)16(26-8)27-15-9-5(1-2-6(9)13(21)22)7(4-25-15)14(23)24/h2,4-5,8-12,15-20H,1,3H2,(H,21,22)(H,23,24)
0 references
InChIKey
AYRQUPRKTDTPEN-UHFFFAOYSA-N
0 references
PubChem CID
75051789
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AYRQUPRKTDTPEN-UHFFFAOYSA-N
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