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(Q104955611)
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English
Tricosyl (e)-ferulate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
mass
516.417860272
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₃H₅₆O₄
0 references
canonical SMILES
O=C(OCCCCCCCCCCCCCCCCCCCCCCC)C=CC1=CC=C(O)C(OC)=C1
0 references
isomeric SMILES
CCCCCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/c1ccc(O)c(OC)c1
1 reference
based on heuristic
inferred from InChI
found in taxon
Schnella guianensis
1 reference
stated in
Chemical Investigations of Tropical Medicinal Plants, XXI [1] Long Chain Alkyl Esters of Ferulic and p-Coumaric Acid from Bauhinia manca
Engelhardia roxburghiana
1 reference
stated in
Secondary metabolites from the roots of Engelhardia roxburghiana and their antitubercular activities
Identifiers
InChI
InChI=1S/C33H56O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-37-33(35)27-25-30-24-26-31(34)32(29-30)36-2/h24-27,29,34H,3-23,28H2,1-2H3/b27-25+
0 references
InChIKey
CEEUWLXYNIWFHF-IMVLJIQESA-N
0 references
PubChem CID
92042444
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
96941110
1 reference
stated in
UniChem
KNApSAcK ID
C00034729
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CEEUWLXYNIWFHF-IMVLJIQESA-N
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