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(Q104988951)
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English
[6-[2-(3,4-Dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate
group of stereoisomers with the chemical formula C₂₉H₃₆O₁₅
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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
624.205420452
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₃₆O₁₅
0 references
canonical SMILES
O=C(OC1C(O)C(O)C(OCCC2=CC=C(O)C(O)=C2)OC1COC3OC(C)C(O)C(O)C3O)C=CC4=CC=C(O)C(O)=C4
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found in taxon
Globularia alypum
1 reference
stated in
In vitro antioxidant effect of Globularia alypum L. hydromethanolic extract
Identifiers
InChI
InChI=1S/C29H36O15/c1-13-22(35)23(36)25(38)29(42-13)41-12-20-27(44-21(34)7-4-14-2-5-16(30)18(32)10-14)24(37)26(39)28(43-20)40-9-8-15-3-6-17(31)19(33)11-15/h2-7,10-11,13,20,22-33,35-39H,8-9,12H2,1H3
0 references
InChIKey
DTOUWTJYUCZJQD-UHFFFAOYSA-N
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PubChem CID
4484391
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DTOUWTJYUCZJQD-UHFFFAOYSA-N
UniChem compound ID
24994498
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0252460
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DTOUWTJYUCZJQD-UHFFFAOYSA-N
Probes And Drugs ID
PD056702
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