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(Q104917292)
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English
methyl 7-acetyloxy-5-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
group of stereoisomers with the chemical formula C₁₉H₂₈O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
iridoid
1 reference
inferred from
iridoid
mass
448.15807633599974
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₈O₁₂
0 references
canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(O)CC3(OC(=O)C)C
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found in taxon
Stachys tenuifolia
1 reference
stated in
Iridoid glycosides from Eremostachys glabra
Phlomis spinidens
1 reference
stated in
Phlorigidosides A-C, iridoid glucosides from Phlomis rigida
Phlomis rigida
1 reference
stated in
Phlomisflavosides A and B, new flavonol bisglycosides from Phlomis spinidens.
Barleria prionitis
2 references
stated in
Iridoid glucosides from Barleria lupulina
stated in
The Minor Iridoid Glucosides of Barleria lupulina: Isolation, Crystal Structure and Plant Growth-Inhibiting Properties of 6-O-Acetylshanzhiside Methyl Ester
Phlomoides rotata
2 references
stated in
A new iridoid glucoside from Lamiophlomis rotata
stated in
Iridoid Glycosides fromLamiophlomis rotata
Identifiers
InChI
InChI=1S/C19H28O12/c1-7(21)31-19(2)4-9(22)11-8(16(26)27-3)6-28-17(12(11)19)30-18-15(25)14(24)13(23)10(5-20)29-18/h6,9-15,17-18,20,22-25H,4-5H2,1-3H3
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InChIKey
ARFRZOLTIRQFCI-UHFFFAOYSA-N
0 references
PubChem CID
18759764
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
24198761
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0248874
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ARFRZOLTIRQFCI-UHFFFAOYSA-N
Probes And Drugs ID
PD087580
0 references
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