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CHEBI:181937 - [(6Ar,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate

Default Structure
ChEBI IDCHEBI:181937
ChEBI Name[(6Ar,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30N2O2
Net Charge0
Average Mass366.505
Monoisotopic Mass366.23073
SMILES[H][C@@]12c3cccc4nc(C(C)(C)C=C)c(c34)C[C@@]1([H])N(C)C[C@@H](C)[C@@H]2OC(C)=O
InChIInChI=1S/C23H30N2O2/c1-7-23(4,5)22-16-11-18-20(15-9-8-10-17(24-22)19(15)16)21(27-14(3)26)13(2)12-25(18)6/h7-10,13,18,20-21,24H,1,11-12H2,2-6H3/t13-,18-,20-,21+/m1/s1
InChIKeyOSICWVVWEXKSBD-NDKINLCJSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
[(6Ar,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate (CHEBI:181937) is a alkaloid (CHEBI:22315)
IUPAC Name 
[(6aR,9R,10S,10aR)-7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-g]quinolin-10-yl] acetate
Manual XrefsDatabases
8220005ChemSpider
C20438KEGG COMPOUND