EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:199422 - (7-Isopropenyl-4-methyl-6,7-dihydro-1-az

ChEBI IDCHEBI:199422
ChEBI Name(7-Isopropenyl-4-methyl-6,7-dihydro-1-az
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H52O2
Net Charge0
Average Mass480.777
Monoisotopic Mass480.39673
SMILESC=C(C)[C@@H]1C=C2C(COC(=O)CCCCCCCCCCCCCCCCC)=CC=C2C(C)=CC1
InChIInChI=1S/C33H52O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-33(34)35-26-30-23-24-31-28(4)21-22-29(27(2)3)25-32(30)31/h21,23-25,29H,2,5-20,22,26H2,1,3-4H3/t29-/m0/s1
InChIKeyJJOMKEHSADWVHT-LJAQVGFWSA-N
Species of MetaboliteComponentSourceComments
Lactarius chrysorrheus (ncbitaxon:111135) - DOI (10.1016/0031-9422(88)80597-1)
ChEBI Ontology
Outgoing Relation(s)
(7-Isopropenyl-4-methyl-6,7-dihydro-1-az (CHEBI:199422) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4-methyl-7-prop-1-en-2-yl-6,7-dihydroazulen-1-yl)methyl octadecanoate
Manual XrefsDatabases
171623ChemSpider