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(Q104915875)
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English
methyl 4'-(1-hydroxyethyl)-5'-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate
group of stereoisomers with the chemical formula C₂₁H₂₆O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
470.142426272
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₆O₁₂
0 references
canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C=CC43OC(=O)C(=C4)C(O)C
0 references
found in taxon
Pinalia bicolor
1 reference
stated in
Structural modifications of plumieride isolated from Plumeria bicolor and the effect of these modifications on in vitro anticancer activity
Plumeria obtusa
1 reference
stated in
Isolation and characterization of secondary metabolites from Plumeria obtusa
Identifiers
InChI
InChI=1S/C21H26O12/c1-8(23)10-5-21(33-18(10)28)4-3-9-11(17(27)29-2)7-30-19(13(9)21)32-20-16(26)15(25)14(24)12(6-22)31-20/h3-5,7-9,12-16,19-20,22-26H,6H2,1-2H3
0 references
InChIKey
AOPMSFXOYJXDNJ-UHFFFAOYSA-N
0 references
PubChem CID
3453259
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
AOPMSFXOYJXDNJ-UHFFFAOYSA-N
UniChem compound ID
50268370
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0256647
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AOPMSFXOYJXDNJ-UHFFFAOYSA-N
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