Home
Random
Nearby
Log in
Settings
Donate
About Wikidata
Disclaimers
Search
(Q105248876)
Watch
English
2-O-Caffeoylarbutin
group of stereoisomers with the chemical formula C₂₁H₂₂O₁₀
In more languages
edit
Statements
instance of
group of stereoisomers
0 references
subclass of
alkyl caffeate ester
1 reference
inferred from
alkyl caffeate ester
mass
434.121296904
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₂O₁₀
0 references
canonical SMILES
O=C(OC1C(OC2=CC=C(O)C=C2)OC(CO)C(O)C1O)C=CC3=CC=C(O)C(O)=C3
0 references
isomeric SMILES
O=C(/C=C/c1ccc(O)c(O)c1)OC1C(Oc2ccc(O)cc2)OC(CO)C(O)C1O
1 reference
based on heuristic
inferred from InChI
found in taxon
Vaccinium vitis-idaea
1 reference
stated in
1082. Phenolic constituents of Vaccinium vitis idaea L
Identifiers
InChI
InChI=1S/C21H22O10/c22-10-16-18(27)19(28)20(21(30-16)29-13-5-3-12(23)4-6-13)31-17(26)8-2-11-1-7-14(24)15(25)9-11/h1-9,16,18-25,27-28H,10H2/b8-2+
0 references
InChIKey
SAHZOJQMDIDFST-KRXBUXKQSA-N
0 references
PubChem CID
131751154
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SAHZOJQMDIDFST-KRXBUXKQSA-N
ChEBI ID
191509
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H22O10/c22-10-16-18(27)19(28)20(21(30-16)29-13-5-3-12(23)4-6-13)31-17(26)8-2-11-1-7-14(24)15(25)9-11/h1-9,16,18-25,27-28H,10H2/b8-2+
UniChem compound ID
32002094
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0031347
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SAHZOJQMDIDFST-KRXBUXKQSA-N
Sitelinks
Wikipedia
(0 entries)
edit
Wikibooks
(0 entries)
edit
Wikinews
(0 entries)
edit
Wikiquote
(0 entries)
edit
Wikisource
(0 entries)
edit
Wikiversity
(0 entries)
edit
Wikivoyage
(0 entries)
edit
Wiktionary
(0 entries)
edit
Multilingual sites
(0 entries)
edit
