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(Q105140339)
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English
[(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
group of stereoisomers with the chemical formula C₂₉H₃₆O₁₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
alkyl caffeate ester
1 reference
inferred from
alkyl caffeate ester
mass
640.5877
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₃₆O₁₆
0 references
canonical SMILES
O=C(OC1C(OC(OCCC2=CC=C(O)C(O)=C2)C(O)C1OC3OC(CO)C(O)C(O)C3O)CO)C=CC4=CC=C(O)C(O)=C4
0 references
found in taxon
Plantago lanceolata
2 references
stated in
Phenylethanoid glucosides from in vitro propagated plants and callus cultures of Plantago lanceolata
stated in
Phenolic compounds from Plantago asiatica
Plantago asiatica
1 reference
stated in
Structure and antibacterial activity of plantamajoside, a caffeic acid sugar ester from Plantago major subs major
Identifiers
InChI
InChI=1S/C29H36O16/c30-11-19-22(37)23(38)24(39)29(42-19)45-27-25(40)28(41-8-7-14-2-5-16(33)18(35)10-14)43-20(12-31)26(27)44-21(36)6-3-13-1-4-15(32)17(34)9-13/h1-6,9-10,19-20,22-35,37-40H,7-8,11-12H2
0 references
InChIKey
KFEFLPDKISUVNR-UHFFFAOYSA-N
0 references
PubChem CID
4484595
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
62049129
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0256632
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KFEFLPDKISUVNR-UHFFFAOYSA-N
Probes And Drugs ID
PD056614
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