EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:41251 - (3R)-3-{[(TETRADECYLAMINO)CARBONYL]AMINO}-4-(TRIMETHYLAMMONIO)BUTANOATE

Default Structure
ChEBI IDCHEBI:41251
ChEBI Name(3R)-3-{[(TETRADECYLAMINO)CARBONYL]AMINO}-4-(TRIMETHYLAMMONIO)BUTANOATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC22H45N3O3
Net Charge0
Average Mass399.620
Monoisotopic Mass399.34609
SMILES[H]N(C(=O)N([H])[C@]([H])(C([H])([H])C(=O)[O-])C([H])([H])[N+](C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]
InChIInChI=1S/C22H45N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-22(28)24-20(18-21(26)27)19-25(2,3)4/h20H,5-19H2,1-4H3,(H2-,23,24,26,27,28)/t20-/m1/s1
InChIKeyBMZYTDRMCBZVNH-HXUWFJFHSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-3-{[(TETRADECYLAMINO)CARBONYL]AMINO}-4-(TRIMETHYLAMMONIO)BUTANOATE (CHEBI:41251) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(3R)-3-{[(TETRADECYLAMINO)CARBONYL]AMINO}-4-(TRIMETHYLAMMONIO)BUTANOATEPDBeChem
(3R)-3-[(tetradecylcarbamoyl)amino]-4-(trimethylammonio)butanoatePDBeChem
Manual XrefsDatabases
BUIPDBeChem