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CHEBI:233613 - (2S,3S)-NLD

ChEBI IDCHEBI:233613
ChEBI Name(2S,3S)-NLD
Stars
ASCII Name(2S,3S)-NLD
DefinitionA [1-methyl-2-(pyridin-3-yl)pyrrolidin-3-yl]methyl 4-(ethylamino)-4-oxobutanoate that has (2S,3S)-configuration.
Last Modified4 March 2025
SubmitterAdnan
DownloadsMolfile
FormulaC17H25N3O3
Net Charge0
Average Mass319.405
Monoisotopic Mass319.18959
SMILES[H][C@@]1(c2cccnc2)[C@@H](COC(=O)CCC(=O)NCC)CCN1C
InChIInChI=1S/C17H25N3O3/c1-3-19-15(21)6-7-16(22)23-12-14-8-10-20(2)17(14)13-5-4-9-18-11-13/h4-5,9,11,14,17H,3,6-8,10,12H2,1-2H3,(H,19,21)/t14-,17-/m1/s1
InChIKeyWOXOYXFKTXCZIL-RHSMWYFYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-NLD (CHEBI:233613) is a [1-methyl-2-(pyridin-3-yl)pyrrolidin-3-yl]methyl 4-(ethylamino)-4-oxobutanoate (CHEBI:233616)
(2S,3S)-NLD (CHEBI:233613) is enantiomer of (2R,3R)-NLD (CHEBI:233612)
Incoming Relation(s)
NLD (CHEBI:233614) has part (2S,3S)-NLD (CHEBI:233613)
(2R,3R)-NLD (CHEBI:233612) is enantiomer of (2S,3S)-NLD (CHEBI:233613)
IUPAC Name 
[(2S,3S)-1-methyl-2-(pyridin-3-yl)pyrrolidin-3-yl]methyl 4-(ethylamino)-4-oxobutanoate
Synonym  Source
(7S,11S)-NLDChEBI
Citations