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(Q105329778)
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English
4-[2,2,6-Trimethyl-4-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxycyclohexyl]butan-2-one
group of stereoisomers with the chemical formula C₂₅H₄₄O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
megastigmane
1 reference
inferred from
megastigmane
mass
520.288362228
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₄₄O₁₁
0 references
canonical SMILES
O=C(C)CCC1C(C)CC(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)CC1(C)C
0 references
found in taxon
Aquilegia viridiflora
2 references
stated in
Two labdane diterpene and megastigmane glycosides from Aquilegia hybrida
stated in
Two new cycloartane glycosides from the underground parts of Aquilegia vulgaris
Identifiers
InChI
InChI=1S/C25H44O11/c1-11-8-14(9-25(4,5)15(11)7-6-12(2)26)35-24-22(32)20(30)18(28)16(36-24)10-33-23-21(31)19(29)17(27)13(3)34-23/h11,13-24,27-32H,6-10H2,1-5H3
0 references
InChIKey
XKYNOSKPNRIVGQ-UHFFFAOYSA-N
0 references
PubChem CID
162976731
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XKYNOSKPNRIVGQ-UHFFFAOYSA-N
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