CHEBI:202939 - Catathelasmol E

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Catathelasmol E
ChEBI ID CHEBI:202939
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H16O5
Net Charge 0
Average Mass 204.222
Monoisotopic Mass 204.09977
InChI InChI=1S/C9H16O5/c1-7(10)13-5-3-4-9(12)6-14-8(2)11/h9,12H,3-6H2,1-2H3/t9-/m0/s1
InChIKey IINLCSVXAQHGFW-VIFPVBQESA-N
SMILES O=C(OC[C@@H](O)CCCOC(=O)C)C
Metabolite of Species Details
Catathelasma imperiale (NCBI:txid181976) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Catathelasmol E (CHEBI:202939) is a dicarboxylic acid (CHEBI:35692)
IUPAC Name
[(4S)-5-acetyloxy-4-hydroxypentyl] acetate
Manual Xref Database
78440920 ChemSpider
View more database links