CHEBI:68306 - bulbisine Trifluoroacetic acid

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ChEBI Name bulbisine Trifluoroacetic acid
ChEBI ID CHEBI:68306
Definition A natural product found in Crinum asiaticum var. sinicum.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H22F3NO7
Net Charge 0
Average Mass 433.37570
Monoisotopic Mass 433.13484
InChI InChI=1S/C17H21NO5.C2HF3O2/c1-21-14-9-7-18-5-4-17(13(18)3-2-11(19)16(17)20)10(9)6-12-15(14)23-8-22-12;3-2(4,5)1(6)7/h6,11,13,16,19-20H,2-5,7-8H2,1H3;(H,6,7)/t11-,13+,16-,17-;/m0./s1
InChIKey GKYNBKUEZVMORG-JJTLMRPKSA-N
SMILES OC(=O)C(F)(F)F.[H][C@@]12CC[C@H](O)[C@H](O)[C@]11CCN2Cc2c(OC)c3OCOc3cc12
Metabolite of Species Details
Crinum asiaticum var. sinicum (NCBI:txid223245) Found in leaf (BTO:0000713). 95% ethanolic extract of dried, powdered leaves See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing bulbisine Trifluoroacetic acid (CHEBI:68306) has role metabolite (CHEBI:25212)
bulbisine Trifluoroacetic acid (CHEBI:68306) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
1-Epideacetylbowdensine Trifluoroacetic acid ChEBI
Crinan-1,2-diol, 7-methoxy-, (1beta,2beta)-Trifluoroacetic acid ChEBI
Registry Number Type Source
101219-55-0 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21314165 PubMed citation Europe PMC