EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:224688 - Marinacarboline H

ChEBI IDCHEBI:224688
ChEBI NameMarinacarboline H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H19N3O3
Net Charge0
Average Mass385.423
Monoisotopic Mass385.14264
SMILESCO[C@@]1(C)N(/C=C\c2ccccc2)C(=O)c2cc3c(nc4ccccc43)c(=O)n21
InChIInChI=1S/C23H19N3O3/c1-23(29-2)25(13-12-15-8-4-3-5-9-15)21(27)19-14-17-16-10-6-7-11-18(16)24-20(17)22(28)26(19)23/h3-14,24H,1-2H3/b13-12-/t23-/m0/s1
InChIKeySURJBUWWTULNRV-FRHQNKJESA-N
Species of MetaboliteComponentSourceComments
Actinoalloteichus (ncbitaxon:65496) - PubMed (32864967)
ChEBI Ontology
Outgoing Relation(s)
Marinacarboline H (CHEBI:224688) is a β-carbolines (CHEBI:60834)
IUPAC Name 
(12S)-12-methoxy-12-methyl-13-[(Z)-2-phenylethenyl]-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,15-pentaene-10,14-dione
Manual XrefsDatabases
92172157ChemSpider