CHEBI:70076 - Stachyline B

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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.
Supplier Information
Download Molfile XML SDF
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 (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 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 Waiting for Citations 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);