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CHEBI:227652 - Aspewentin H

ChEBI IDCHEBI:227652
ChEBI NameAspewentin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILESC=C[C@@]1(C)CCc2c3c(cc(O)c2[C@@H]1O)C(C)(C)[C@H](O)CC3
InChIInChI=1S/C19H26O3/c1-5-19(4)9-8-12-11-6-7-15(21)18(2,3)13(11)10-14(20)16(12)17(19)22/h5,10,15,17,20-22H,1,6-9H2,2-4H3/t15-,17+,19+/m1/s1
InChIKeyJTSCFAASGVXBPT-AYBZRNKSSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (27148955)
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)
Aspewentin H (CHEBI:227652) is a phenanthrol (CHEBI:25962)
IUPAC Name 
(1R,2R,7R)-2-ethenyl-2,8,8-trimethyl-1,3,4,5,6,7-hexahydrophenanthrene-1,7,10-triol
Manual XrefsDatabases
58196871ChemSpider