EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:202493 - Marcfortine C

ChEBI IDCHEBI:202493
ChEBI NameMarcfortine C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H33N3O3
Net Charge0
Average Mass447.579
Monoisotopic Mass447.25219
SMILESCC1(C)C=Cc2c(ccc3c2NC(=O)[C@@]32C[C@@]34CN5CCCC[C@]5(C[C@@H]3C2(C)C)C(=O)N4)O1
InChIInChI=1S/C27H33N3O3/c1-23(2)11-9-16-18(33-23)8-7-17-20(16)28-22(32)27(17)14-25-15-30-12-6-5-10-26(30,21(31)29-25)13-19(25)24(27,3)4/h7-9,11,19H,5-6,10,12-15H2,1-4H3,(H,28,32)(H,29,31)/t19-,25-,26+,27-/m1/s1
InChIKeyMEDWEEBWLKOHES-ABMOCFRJSA-N
Species of MetaboliteComponentSourceComments
Penicillium roqueforti (ncbitaxon:5082) - DOI (10.1016/s0040-4039(01)92883-7)
ChEBI Ontology
Outgoing Relation(s)
Marcfortine C (CHEBI:202493) is a amino acid amide (CHEBI:22475)
IUPAC Name 
(1'S,3R,8'S,10'R)-7,7,11',11'-tetramethylspiro[1H-pyrano[2,3-g]indole-3,12'-3,14-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-2,15'-dione