EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:221697 - Hancockiamide D

ChEBI IDCHEBI:221697
ChEBI NameHancockiamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26N2O3
Net Charge0
Average Mass342.439
Monoisotopic Mass342.19434
SMILESCOc1cc(C[C@H]2CN[C@@H](Cc3ccccc3)CN2)cc(OC)c1O
InChIInChI=1S/C20H26N2O3/c1-24-18-10-15(11-19(25-2)20(18)23)9-17-13-21-16(12-22-17)8-14-6-4-3-5-7-14/h3-7,10-11,16-17,21-23H,8-9,12-13H2,1-2H3/t16-,17-/m0/s1
InChIKeyXSGLOXNZKHLMNE-IRXDYDNUSA-N
Species of MetaboliteComponentSourceComments
Aspergillus hancockii (ncbitaxon:1873369) - PubMed (33242032)
ChEBI Ontology
Outgoing Relation(s)
Hancockiamide D (CHEBI:221697) is a methoxybenzenes (CHEBI:51683)
Hancockiamide D (CHEBI:221697) is a phenols (CHEBI:33853)
Hancockiamide D (CHEBI:221697) is conjugate base of hancockiamide D (1+) (CHEBI:231787)
Incoming Relation(s)
hancockiamide D (1+) (CHEBI:231787) is conjugate acid of Hancockiamide D (CHEBI:221697)