CHEBI:229032 - 6-Methylcryptotanshinone [14,16-epoxy-6-methyl-5(10),6,8,13-abietatetraene-11,12-dione]

ChEBI IDCHEBI:229032
ChEBI Name6-Methylcryptotanshinone [14,16-epoxy-6-methyl-5(10),6,8,13-abietatetraene-11,12-dione]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O3
Net Charge0
Average Mass310.393
Monoisotopic Mass310.15689
SMILESCc1cc2c(c3c1C(C)(C)CCC3)C(=O)C(=O)C1=C2OC[C@@H]1C
InChIInChI=1S/C20H22O3/c1-10-8-13-15(12-6-5-7-20(3,4)16(10)12)18(22)17(21)14-11(2)9-23-19(13)14/h8,11H,5-7,9H2,1-4H3/t11-/m0/s1
InChIKeyMXBUDAJPBGIUNL-NSHDSACASA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
6-Methylcryptotanshinone [14,16-epoxy-6-methyl-5(10),6,8,13-abietatetraene-11,12-dione] (CHEBI:229032) is a abietane diterpenoid (CHEBI:36762)
IUPAC Name 
(1R)-1,5,6,6-tetramethyl-2,7,8,9-tetrahydro-1H-naphtho[1,2-g][1]benzouran-10,11-dione
Manual XrefsDatabases
4477841ChemSpider