CHEBI:223910 - Xylarinorditerpene J

ChEBI IDCHEBI:223910
ChEBI NameXylarinorditerpene J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H32O2
Net Charge0
Average Mass292.463
Monoisotopic Mass292.24023
SMILESC[C@]1(CCO)CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC[C@]3(C)O)C1
InChIInChI=1S/C19H32O2/c1-17(11-12-20)10-7-15-14(13-17)5-6-16-18(15,2)8-4-9-19(16,3)21/h5,15-16,20-21H,4,6-13H2,1-3H3/t15-,16+,17+,18+,19-/m0/s1
InChIKeyHCINTOUWEBPUIJ-VHPHOLNESA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (31961677)
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)
Xylarinorditerpene J (CHEBI:223910) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(1S,4aR,4bS,7S,10aR)-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-ol