CHEBI:197907 - HS071

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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 HS071
ChEBI ID CHEBI:197907
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H18O4
Net Charge 0
Average Mass 226.272
Monoisotopic Mass 226.12051
InChI InChI=1S/C12H18O4/c1-3-4-5-6-10-11(12(14)15-2)9(7-13)8-16-10/h8,13H,3-7H2,1-2H3
InChIKey BBRGDPBUQJUNSV-UHFFFAOYSA-N
SMILES O=C(OC)C1=C(OC=C1CO)CCCCC
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing HS071 (CHEBI:197907) has functional parent 2-furoic acid (CHEBI:30845)
HS071 (CHEBI:197907) is a carboxylic ester (CHEBI:33308)
IUPAC Name
methyl 4-(hydroxymethyl)-2-pentyluran-3-carboxylate
Manual Xref Database
28285848 ChemSpider
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