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(Q110199646)
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English
(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one
group of stereoisomers with the chemical formula C₂₁H₃₀O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
410.19406792
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₀O₈
0 references
canonical SMILES
O=C1C2=C(C(=C(C=C2C(O)C1(C)C)C)CCOC3OC(CO)C(O)C(O)C3O)C
0 references
found in taxon
Pteridium
1 reference
stated in
Structure of Pteroside Z and D, Glycosides of Pteridium aquilinum var. latiusculum
Identifiers
InChI
InChI=1S/C21H30O8/c1-9-7-12-14(19(27)21(3,4)18(12)26)10(2)11(9)5-6-28-20-17(25)16(24)15(23)13(8-22)29-20/h7,13,15-18,20,22-26H,5-6,8H2,1-4H3
0 references
InChIKey
TUGWHBZURNWRDG-UHFFFAOYSA-N
0 references
PubChem CID
12314746
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TUGWHBZURNWRDG-UHFFFAOYSA-N
UniChem compound ID
32003809
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0036603
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TUGWHBZURNWRDG-UHFFFAOYSA-N
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