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CHEBI:70428 - Buxamine A

ChEBI IDCHEBI:70428
ChEBI NameBuxamine A
Stars
DefinitionA natural product found in Buxus natalensis and Buxus papillosa.
Last Modified22 September 2014
DownloadsMolfile
FormulaC28H48N2
Net Charge0
Average Mass412.706
Monoisotopic Mass412.38175
SMILES[H][C@@]12CC[C@]3([H])C(=CC[C@@]4(C)[C@@]3(C)CC[C@]4([H])[C@H](C)N(C)C)C=C1CC[C@H](N(C)C)C2(C)C
InChIInChI=1S/C28H48N2/c1-19(29(6)7)22-15-17-28(5)24-12-11-23-20(18-21(24)14-16-27(22,28)4)10-13-25(30(8)9)26(23,2)3/h14,18-19,22-25H,10-13,15-17H2,1-9H3/t19-,22+,23+,24+,25-,27+,28-/m0/s1
InChIKeyZUILVKYUNYJWMV-JTRBZCFYSA-N
Species of MetaboliteComponentSourceComments
Buxus natalensis (IPNI:128681-1) bark (BTO:0001301) PubMed (20954721) MeOH extract of pulverized bark
Buxus papillosa (IPNI:128688-1) - PubMed (20954721)
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Buxamine A (CHEBI:70428) has role metabolite (CHEBI:25212)
Buxamine A (CHEBI:70428) is a steroid alkaloid (CHEBI:26767)
Registry NumbersSources
CAS:36127-40-9ChemIDplus
Citations