CHEBI:222905 - Spiromastol F

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 Spiromastol F
ChEBI ID CHEBI:222905
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H21ClO6
Net Charge 0
Average Mass 380.820
Monoisotopic Mass 380.10267
InChI InChI=1S/C19H21ClO6/c1-3-5-10-7-11(21)8-14(23)18(10)26-15-9-13(22)17(20)12(6-4-2)16(15)19(24)25/h7-9,21-23H,3-6H2,1-2H3,(H,24,25)
InChIKey PIIGCNHACGUFBN-UHFFFAOYSA-N
SMILES ClC1=C(O)C=C(OC2=C(O)C=C(O)C=C2CCC)C(=C1CCC)C(=O)O
Metabolite of Species Details
Spiromastigoides (NCBI:txid37234) See: PubMed
ChEBI Ontology
Outgoing Spiromastol F (CHEBI:222905) is a aromatic ether (CHEBI:35618)
IUPAC Name
3-chloro-6-(2,4-dihydroxy-6-propylphenoxy)-4-hydroxy-2-propylbenzoic acid
Manual Xref Database
35516944 ChemSpider
View more database links