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CHEBI:220249 - Scopararane D

ChEBI IDCHEBI:220249
ChEBI NameScopararane D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O4
Net Charge0
Average Mass304.386
Monoisotopic Mass304.16746
SMILESC=CC1C=C2C(=O)C(O)=C3C(CCC(O)C3(C)C)[C@@]2(O)CC1
InChIInChI=1S/C18H24O4/c1-4-10-7-8-18(22)11-5-6-13(19)17(2,3)14(11)16(21)15(20)12(18)9-10/h4,9-11,13,19,21-22H,1,5-8H2,2-3H3/t10?,11?,13?,18-/m0/s1
InChIKeyRBCSLMHDDJQRHE-GNTHLIOLSA-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 D (CHEBI:220249) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(4bS)-7-ethenyl-2,4b,10-trihydroxy-1,1-dimethyl-3,4,4a,5,6,7-hexahydro-2H-phenanthren-9-one
Manual XrefsDatabases
78443765ChemSpider