CHEBI:69802 - 6'-O-Caffeoylcatalpol

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ChEBI Name 6'-O-Caffeoylcatalpol
ChEBI ID CHEBI:69802
Definition A natural product found in Veronica lavaudiana.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H28O13
Net Charge 0
Average Mass 524.47130
Monoisotopic Mass 524.15299
InChI InChI=1S/C24H28O13/c25-9-24-16-11(17(29)21(24)37-24)5-6-33-22(16)36-23-20(32)19(31)18(30)14(35-23)8-34-15(28)4-2-10-1-3-12(26)13(27)7-10/h1-7,11,14,16-23,25-27,29-32H,8-9H2/b4-2+/t11-,14-,16-,17+,18-,19+,20-,21+,22+,23+,24-/m1/s1
InChIKey KNJZBAUYPCGTFR-UTOUBEBWSA-N
SMILES [H][C@]1(O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1OC=C[C@@]2([H])[C@H](O)[C@]3([H])O[C@]3(CO)[C@@]12[H]
Metabolite of Species Details
Veronica lavaudiana (NCBI:txid124267) MeOH extract of plant material See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 6'-O-Caffeoylcatalpol (CHEBI:69802) has role metabolite (CHEBI:25212)
6'-O-Caffeoylcatalpol (CHEBI:69802) is a hydroxycinnamic acid (CHEBI:24689)
Citation Waiting for Citations Type Source
21568305 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:cinnamate ester(CHEBI:36087); ISA:glycoside(CHEBI:24400); ISA:olefinic compound(CHEBI:78840); ISA:catechols(CHEBI:33566); ISA:styrenes(CHEBI:26799); ISA:fatty acid ester(CHEBI:35748); ISA:oxanes(CHEBI:46942); ISA:monosaccharide(CHEBI:35381); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:acetal(CHEBI:59769); ISA:epoxide(CHEBI:32955); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586); ISA:primary alcohol(CHEBI:15734); ISA:aromatic alcohol(CHEBI:33854);