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(Q105224317)
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English
NCGC00384848-01_C21H36O10_2-[3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2-oxodecahydro-5-azulenyl]-2-propanyl hexopyranoside
group of stereoisomers with the chemical formula C₂₁H₃₆O₁₀
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Statements
instance of
group of stereoisomers
0 references
subclass of
guaiane sesquiterpenoid
1 reference
inferred from
guaiane sesquiterpenoid
mass
448.230847352
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₆O₁₀
0 references
canonical SMILES
O=C1CC2C(CC(CCC2(O)CO)C(OC3OC(CO)C(O)C(O)C3O)(C)C)C1(O)C
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found in taxon
Atractylodes macrocephala
1 reference
stated in
Glycosides of Atractylodes lancea
Atractylodes japonica
3 references
stated in
Glycosides of Atractylodes ovata
stated in
Glycosides of Atractylodes japonica
stated in
Glycosides of Atractylodes lancea
Atractylodes lancea
1 reference
stated in
Glycosides of Atractylodes japonica
Identifiers
InChI
InChI=1S/C21H36O10/c1-19(2,31-18-17(27)16(26)15(25)13(8-22)30-18)10-4-5-21(29,9-23)12-7-14(24)20(3,28)11(12)6-10/h10-13,15-18,22-23,25-29H,4-9H2,1-3H3
0 references
InChIKey
QNBLVYVBWDIWDM-UHFFFAOYSA-N
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PubChem CID
14507473
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
52129587
1 reference
stated in
UniChem
Probes And Drugs ID
PD065094
0 references
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