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CHEBI:68308 - 7-methoxycrinamabine Trifluoroacetic acid

Default Structure
ChEBI IDCHEBI:68308
ChEBI Name7-methoxycrinamabine Trifluoroacetic acid
Stars
DefinitionA natural product found in Crinum asiaticum var. sinicum.
DownloadsMolfile
FormulaC17H21NO6.C2HF3O2
Net Charge0
Average Mass449.378
Monoisotopic Mass449.12975
SMILESCOc1c2c(cc3c1OCO3)[C@@]13CCN(C2)[C@]1(O)CC[C@H](O)[C@@H]3O.O=C(O)C(F)(F)F
InChIInChI=1S/C17H21NO6.C2HF3O2/c1-22-13-9-7-18-5-4-16(10(9)6-12-14(13)24-8-23-12)15(20)11(19)2-3-17(16,18)21;3-2(4,5)1(6)7/h6,11,15,19-21H,2-5,7-8H2,1H3;(H,6,7)/t11-,15-,16+,17-;/m0./s1
InChIKeyOWHCYEHBEJOKHM-YJLXOADBSA-N
Species of MetaboliteComponentSourceComments
Crinum asiaticum var. sinicum (ncbitaxon:223245) leaf (BTO:0000713) PubMed (21314165) 95% ethanolic extract of dried, powdered leaves
Roles Classification
Biological Role:
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)
7-methoxycrinamabine Trifluoroacetic acid (CHEBI:68308) has role metabolite (CHEBI:25212)
7-methoxycrinamabine Trifluoroacetic acid (CHEBI:68308) is a organic molecular entity (CHEBI:50860)
Citations