EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:221721 - Hancockiamide I

ChEBI IDCHEBI:221721
ChEBI NameHancockiamide I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H36N2O5
Net Charge0
Average Mass600.715
Monoisotopic Mass600.26242
SMILESCOc1cc(C[C@H]2CN(C(=O)/C=C/c3ccccc3)[C@@H](Cc3ccccc3)CN2C(=O)/C=C/c2ccccc2)cc2c1OCO2
InChIInChI=1S/C38H36N2O5/c1-43-34-23-31(24-35-38(34)45-27-44-35)22-33-26-39(36(41)19-17-28-11-5-2-6-12-28)32(21-30-15-9-4-10-16-30)25-40(33)37(42)20-18-29-13-7-3-8-14-29/h2-20,23-24,32-33H,21-22,25-27H2,1H3/b19-17+,20-18+/t32-,33-/m0/s1
InChIKeyHIHPEJWIPUSVHA-ZSTUBJGKSA-N
Species of MetaboliteComponentSourceComments
Aspergillus hancockii (ncbitaxon:1873369) - PubMed (33242032)
ChEBI Ontology
Outgoing Relation(s)
Hancockiamide I (CHEBI:221721) has functional parent cinnamic acid (CHEBI:27386)
Hancockiamide I (CHEBI:221721) is a olefinic compound (CHEBI:78840)