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CHEBI:226559 - Verrulactone C

ChEBI IDCHEBI:226559
ChEBI NameVerrulactone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H18O12
Net Charge0
Average Mass558.451
Monoisotopic Mass558.07983
SMILESCOc1cc(O)c2c(c1)[C@@]1(OC2=O)C(C)=CC(=O)[C@]12C(O)=c1c(=O)c(O)cc3oc(O)c4c(=O)cc(OC)c2c4c13
InChIInChI=1S/C29H18O12/c1-9-4-17(33)28(29(9)11-5-10(38-2)6-12(30)18(11)27(37)41-29)23-16(39-3)7-13(31)19-21(23)20-15(40-26(19)36)8-14(32)24(34)22(20)25(28)35/h4-8,30,32,35-36H,1-3H3/t28-,29-/m0/s1
InChIKeyJZRVHFKTEMJGIG-VMPREFPWSA-N
Species of MetaboliteComponentSourceComments
Talaromyces verruculosus (ncbitaxon:198730) - PubMed (24332629)
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
Verrulactone C (CHEBI:226559) is a phenanthrenes (CHEBI:25961)
Manual XrefsDatabases
78441437ChemSpider