CHEBI:182434 - 2-Quinuclidinemethanol, alpha-4-quinolyl, 5-vinyl-

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ChEBI Name 2-Quinuclidinemethanol, alpha-4-quinolyl, 5-vinyl-
ChEBI ID CHEBI:182434
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H22N2O
Net Charge 0
Average Mass 294.398
Monoisotopic Mass 294.17321
InChI InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13?,14?,18?,19-/m0/s1
InChIKey KMPWYEUPVWOPIM-QHQSXHFQSA-N
SMILES O[C@H](C1N2CC(C(C1)CC2)C=C)C=3C=4C(N=CC3)=CC=CC4
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.
(via alkaloid )
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ChEBI Ontology
Outgoing 2-Quinuclidinemethanol, alpha-4-quinolyl, 5-vinyl- (CHEBI:182434) is a cinchona alkaloid (CHEBI:51323)
IUPAC Name
(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol
Manual Xref Database
8047 ChemSpider
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