(+)-malbrancheamide(1+) (CHEBI:145651)

CHEBI:145651 - (+)-malbrancheamide(1+)

Formula	C21H24Cl2N3O
Net Charge	+1
Average Mass	405.349
Monoisotopic Mass	404.12909
SMILES	[H][C@@]12C[C@]34CCC[NH+]3C[C@@]1(Cc1c(nc3cc(Cl)c(Cl)cc13)C2(C)C)NC4=O
InChI	InChI=1S/C21H23Cl2N3O/c1-19(2)16-9-21-4-3-5-26(21)10-20(16,25-18(21)27)8-12-11-6-13(22)14(23)7-15(11)24-17(12)19/h6-7,16,24H,3-5,8-10H2,1-2H3,(H,25,27)/p+1/t16-,20+,21-/m0/s1
InChIKey	GZGGCZADGIBRHT-DQLDELGASA-O

ChEBI Ontology

Outgoing Relation(s)
	(+)-malbrancheamide(1+) (CHEBI:145651) is a organic molecular entity (CHEBI:50860)

UniProt Name	Source
(+)-malbrancheamide	UniProt

Manual Xrefs	Databases
J6P	PDBeChem

Citations