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(Q105131841)
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English
Methyl 5-hydroxy-7-(methylsulfanylcarbonyloxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
group of stereoisomers with the chemical formula C₁₉H₂₆O₁₂S
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Statements
instance of
group of stereoisomers
0 references
subclass of
iridoid
1 reference
inferred from
iridoid
mass
478.1144972719997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₆O₁₂S
0 references
canonical SMILES
O=C(OCC1=CC(O)C2C(=COC(OC3OC(CO)C(O)C(O)C3O)C12)C(=O)OC)SC
0 references
found in taxon
Paederia
1 reference
stated in
Two new acylated iridoid glucosides from the aerial parts of Paederia scandens.
Saprosma scortechinii
1 reference
stated in
Iridoids and anthraquinones from the Malaysian medicinal plant, Saprosma scortechinii (Rubiaceae).
Identifiers
InChI
InChI=1S/C19H26O12S/c1-27-16(25)8-6-28-17(31-18-15(24)14(23)13(22)10(4-20)30-18)11-7(3-9(21)12(8)11)5-29-19(26)32-2/h3,6,9-15,17-18,20-24H,4-5H2,1-2H3
0 references
InChIKey
JNDNZIPLLDTLQK-UHFFFAOYSA-N
0 references
PubChem CID
20203908
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JNDNZIPLLDTLQK-UHFFFAOYSA-N
UniChem compound ID
63275623
1 reference
stated in
UniChem
Probes And Drugs ID
PD117805
0 references
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