EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:41953 - 3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID

Default Structure
ChEBI IDCHEBI:41953
ChEBI Name3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC11H21NO3
Net Charge0
Average Mass215.293
Monoisotopic Mass215.15214
SMILES[H]OC(=O)[C@@]([H])(N([H])C([H])([H])[H])[C@]([H])(O[H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])/C([H])=C(\[H])C([H])([H])[H]
InChIInChI=1S/C11H21NO3/c1-5-6-7-11(2,3)9(13)8(12-4)10(14)15/h5-6,8-9,12-13H,7H2,1-4H3,(H,14,15)/b6-5+/t8-,9-/m0/s1
InChIKeyNPTONCQMXQFBMD-MUNZNRDXSA-N
ChEBI Ontology
Outgoing Relation(s)
3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID (CHEBI:41953) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACIDPDBeChem
4-[(2E)-but-2-en-1-yl]-2,4,5-trideoxy-4-methyl-2-(methylamino)-D-arabinonic acidPDBeChem
Manual XrefsDatabases
DMTPDBeChem