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CHEBI:220255 - Arthrinin C

ChEBI IDCHEBI:220255
ChEBI NameArthrinin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O4
Net Charge0
Average Mass300.354
Monoisotopic Mass300.13616
SMILESCc1cc(O)c2c(c1)[C@H](O)[C@H]1OC(=O)[C@]3(C)CC[C@@H]4C[C@@]24[C@H]13
InChIInChI=1S/C18H20O4/c1-8-5-10-12(11(19)6-8)18-7-9(18)3-4-17(2)15(18)14(13(10)20)22-16(17)21/h5-6,9,13-15,19-20H,3-4,7H2,1-2H3/t9-,13+,14-,15-,17-,18+/m1/s1
InChIKeyVZCXUHPOIGXDPZ-MYCDKFDCSA-N
Species of MetaboliteComponentSourceComments
Arthriniumspecies (ncbitaxon:1756131) - PubMed (21741249)
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)
Arthrinin C (CHEBI:220255) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(1R,8S,9S,12R,15R,17S)-3,8-dihydroxy-5,12-dimethyl-10-oxapentacyclo[7.7.1.01,15.02,7.012,17]heptadeca-2(7),3,5-trien-11-one
Manual XrefsDatabases
26633806ChemSpider