(E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(E)-nesocodin (alcohol-form) zwitterion

ChEBI ID	CHEBI:191394

ChEBI ASCII Name	(E)-nesocodin (alcohol-form) zwitterion

Stars	This entity has been manually annotated by a third party.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C16H19NO5

Net Charge

Average Mass

305.330

Monoisotopic Mass

305.12632

InChI

InChI=1S/C16H19NO5/c1-21-13-9-11(10-14(22-2)15(13)18)5-3-7-17-8-4-6-12(17)16(19)20/h3,5,7,9-10,12H,4,6,8H2,1-2H3,(H,19,20)

InChIKey

OYPJESQPVLJHAA-UHFFFAOYSA-N

SMILES

C(/C=[N+]\1/C(CCC1)C([O-])=O)=C\C=2C=C(C(=C(C2)OC)O)OC

ChEBI Ontology
Outgoing	(E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394) has functional parent (E)-sinapaldehyde (CHEBI:27949) (E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394) has functional parent L-proline (CHEBI:17203) (E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394) is a cinnamaldehydes (CHEBI:23245) (E)-nesocodin (alcohol-form) zwitterion (CHEBI:191394) is a phenols (CHEBI:33853)

Synonym	Source
(E)-nesocodin (alcohol-form)	UniProt

Citation	Type	Source
35074876	PubMed citation	SUBMITTER