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ChEBI
> Main
CHEBI:70076 - Stachyline B
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ChEBI Ontology
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ChEBI Name
Stachyline B
ChEBI ID
CHEBI:70076
Definition
A natural product found in
Stachylidium
species.
Stars
This entity has been manually annotated by a third party.
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Formula
C13H16O4
Net Charge
0
Average Mass
236.26370
Monoisotopic Mass
236.10486
InChI
InChI=1S/C13H16O4/c1-
9(2)
12(14)
8-
17-
11-
5-
3-
10(4-
6-
11)
7-
13(15)
16/h3-
6,12,14H,1,7-
8H2,2H3,(H,15,16)
/t12-
/m1/s1
InChIKey
NTVKQXXUTNSBBQ-GFCCVEGCSA-N
SMILES
CC(=C)[C@H](O)COc1ccc(CC(O)=O)cc1
Metabolite of Species
Details
Stachylidium
(NCBI:txid796327)
Marine derived fungus isolated from sponge Callyspongia sp. cf. C. flammea of strain 220 See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted 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
Stachyline B (
CHEBI:70076
)
has role
metabolite (
CHEBI:25212
)
Stachyline B (
CHEBI:70076
)
is a
monocarboxylic acid (
CHEBI:25384
)
Synonym
Source
2-[4-[(2S)-2-hydroxy-3-methylbut-3-enoxy]phenyl]acetic acid
ChEBI
Citation
Type
Source
21162532
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:aromatic ether(CHEBI:35618); ISA:secondary alcohol(CHEBI:35681); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organic heterocyclic compound(CHEBI:24532); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);