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ChEBI
> Main
CHEBI:70599 - 14-angeloyloxydeltonorcacalol
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ChEBI Name
14-angeloyloxydeltonorcacalol
ChEBI ID
CHEBI:70599
Definition
A natural product found in
Parasenecio deltophyllus
.
Stars
This entity has been manually annotated by a third party.
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Formula
C20H24O5
Net Charge
0
Average Mass
344.40160
Monoisotopic Mass
344.16237
InChI
InChI=1S/C20H24O5/c1-
6-
11(2)
20(23)
25-
10-
15-
16-
12(3)
8-
7-
9-
14(16)
19(24-
5)
18(22)
17(15)
13(4)
21/h6-
7,9,12,22H,8,10H2,1-
5H3/b11-
6-
/t12-
/m0/s1
InChIKey
QCIYZQPUFWEBMV-DSDFTUOUSA-N
SMILES
COc1c(O)c(C(C)=O)c(COC(=O)C(\C)=C/C)c2[C@@H](C)CC=Cc12
Metabolite of Species
Details
Parasenecio deltophyllus
(NCBI:txid186962)
Found in aerial part
(BTO:0001658)
. The air-dried aerial parts were powdered and extracted with petroleum ether-Et2O-MeOH See:
PubMed
Roles Classification
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
14-angeloyloxydeltonorcacalol (
CHEBI:70599
)
has role
metabolite (
CHEBI:25212
)
14-angeloyloxydeltonorcacalol (
CHEBI:70599
)
is a
naphthols (
CHEBI:25392
)
Synonym
Source
[(8S)-
2-
acetyl-
3-
hydroxy-
4-
methoxy-
8-
methyl-
7,8-
dihydronaphthalen-
1-
yl]methyl (Z)-
2-
methylbut-
2-
enoate
ChEBI
Citation
Type
Source
20968296
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:carboxylic ester(CHEBI:33308); HFP:benzyl alcohol(CHEBI:17987); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:acetophenones(CHEBI:22187); ISA:benzyl ether(CHEBI:59859); ISA:aromatic ketone(CHEBI:76224); ISA:carbonyl compound(CHEBI:36586); ISA:fatty acid ester(CHEBI:35748); ISA:aromatic ether(CHEBI:35618); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:enol(CHEBI:33823); ISA:organic heterocyclic compound(CHEBI:24532); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);