CHEBI:215510 - 9-methoxyfumitremorgin C

ChEBI IDCHEBI:215510
ChEBI Name9-methoxyfumitremorgin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H27N3O4
Net Charge0
Average Mass409.486
Monoisotopic Mass409.20016
SMILESCOc1ccc2c3c(nc2c1)[C@H](C=C(C)C)N1C(=O)[C@@H]2CCCN2C(=O)[C@]1(OC)C3
InChIInChI=1S/C23H27N3O4/c1-13(2)10-19-20-16(15-8-7-14(29-3)11-17(15)24-20)12-23(30-4)22(28)25-9-5-6-18(25)21(27)26(19)23/h7-8,10-11,18-19,24H,5-6,9,12H2,1-4H3/t18-,19-,23+/m0/s1
InChIKeyHVVRMHXSUSNCIE-SFYKDHMMSA-N
Species of MetaboliteComponentSourceComments
Aspergillus fischeri (ncbitaxon:36630) - PubMed (32315839)
ChEBI Ontology
Outgoing Relation(s)
9-methoxyfumitremorgin C (CHEBI:215510) is a β-carbolines (CHEBI:60834)
IUPAC Name 
(1R,12S,15S)-1,7-dimethoxy-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4(9),5,7-tetraene-14,20-dione