CHEBI:203640 - Salfredin 4

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 Salfredin 4
ChEBI ID CHEBI:203640
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H14O5
Net Charge 0
Average Mass 250.250
Monoisotopic Mass 250.08412
InChI InChI=1S/C13H14O5/c1-13(2)4-3-8-9(18-13)5-7(6-14)10(11(8)15)12(16)17/h3-5,14-15H,6H2,1-2H3,(H,16,17)
InChIKey SQUWDMLTGSLTBT-UHFFFAOYSA-N
SMILES O=C(O)C1=C(O)C2=C(OC(C)(C)C=C2)C=C1CO
Metabolite of Species Details
Crucibulum (NCBI:txid68774) See: DOI
ChEBI Ontology
Outgoing Salfredin 4 (CHEBI:203640) is a 1-benzopyran (CHEBI:38443)
IUPAC Name
5-hydroxy-7-(hydroxymethyl)-2,2-dimethylchromene-6-carboxylic acid
Manual Xref Database
78435955 ChemSpider
View more database links