CHEBI:206635 - Lobarientalone B

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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 Lobarientalone B
ChEBI ID CHEBI:206635
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H14O8
Net Charge 0
Average Mass 370.313
Monoisotopic Mass 370.06887
InChI InChI=1S/C19H14O8/c1-6-4-9(23-3)8-5-24-19-12-11(18(22)27-19)13(20)7(2)14-16(12)25-15(8)10(6)17(21)26-14/h4,19-20H,5H2,1-3H3/t19-/m0/s1
InChIKey YDLWEZKWYNYYTH-IBGZPJMESA-N
SMILES O=C1OC2=C3C4=C(C(=O)O[C@@H]4OCC=5C(=C1C(=CC5OC)C)O3)C(=C2C)O
Metabolite of Species Details
Lobaria orientalis (NCBI:txid209568) See: PubMed
ChEBI Ontology
Outgoing Lobarientalone B (CHEBI:206635) is a aromatic ether (CHEBI:35618)
IUPAC Name
(1S)-5-hydroxy-13-methoxy-6,11-dimethyl-2,8,16,19-tetraoxapentacyclo[12.4.2.04,18.07,17.010,15]icosa-4(18),5,7(17),10(15),11,13-hexaene-3,9-dione
Manual Xref Database
76795454 ChemSpider
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