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CHEBI:81221 - Kukoamine B

ChEBI IDCHEBI:81221
ChEBI NameKukoamine B
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DownloadsMolfile
FormulaC28H42N4O6
Net Charge0
Average Mass530.666
Monoisotopic Mass530.31044
SMILESNCCCN(CCCCNCCCNC(=O)CCc1ccc(O)c(O)c1)C(=O)CCc1ccc(O)c(O)c1
InChIInChI=1S/C28H42N4O6/c29-13-3-18-32(28(38)12-8-22-6-10-24(34)26(36)20-22)17-2-1-14-30-15-4-16-31-27(37)11-7-21-5-9-23(33)25(35)19-21/h5-6,9-10,19-20,30,33-36H,1-4,7-8,11-18,29H2,(H,31,37)
InChIKeyIWRAOCFRRTWUDF-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Kukoamine B (CHEBI:81221) is a amine (CHEBI:32952)
Manual XrefsDatabases
C17616KEGG COMPOUND
HMDB0060525HMDB