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CHEBI:220261 - Scopararane G

ChEBI IDCHEBI:220261
ChEBI NameScopararane G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26O4
Net Charge0
Average Mass306.402
Monoisotopic Mass306.18311
SMILESC=CC1CCC2=C([C@H](O)C(=O)[C@]3(O)C2CCCC3(C)C)[C@H]1O
InChIInChI=1S/C18H26O4/c1-4-10-7-8-11-12-6-5-9-17(2,3)18(12,22)16(21)15(20)13(11)14(10)19/h4,10,12,14-15,19-20,22H,1,5-9H2,2-3H3/t10?,12?,14-,15-,18+/m0/s1
InChIKeyGHIOOVSMRJABRE-YGDJSBAOSA-N
Species of MetaboliteComponentSourceComments
Eutypella (ncbitaxon:140192) - PubMed (22611352)
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)
Scopararane G (CHEBI:220261) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(1S,8aS,10S)-2-ethenyl-1,8a,10-trihydroxy-8,8-dimethyl-2,3,4,4b,5,6,7,10-octahydro-1H-phenanthren-9-one
Manual XrefsDatabases
78438734ChemSpider