CHEBI:40697 - (1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine

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ChEBI Name (1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
ChEBI ID CHEBI:40697
ChEBI ASCII Name (1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C14H23N3O
Net Charge 0
Average Mass 249.35204
Monoisotopic Mass 249.18411
InChI InChI=1S/C14H23N3O/c1-2-11-7-8-12(9-15)17(11)14(18)13(16)10-5-3-4-6-10/h1,10-13H,3-9,15-16H2/t11-,12-,13-/m0/s1
InChIKey XYVMJMYCUZCIPB-AVGNSLFASA-N
SMILES NC[C@@H]1CC[C@H](C#C)N1C(=O)[C@@H](N)C1CCCC1
ChEBI Ontology
Outgoing (1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine (CHEBI:40697) is a N-acylpyrrolidine (CHEBI:46766)
(1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine (CHEBI:40697) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name
(1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
Synonym Source
(1S)-2-[(2S,5R)-2-(AMINOMETHYL)-5-ETHYNYLPYRROLIDIN-1-YL]-1-CYCLOPENTYL-2-OXOETHANAMINE PDBeChem
Manual Xrefs Databases
AIA PDBeChem
DB07356 DrugBank
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Last Modified
02 May 2013