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CHEBI:40593 - 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-9-METHOXYNONANOIC ACID

Default Structure
ChEBI IDCHEBI:40593
ChEBI Name2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-9-METHOXYNONANOIC ACID
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DownloadsMolfile
FormulaC20H33NO3
Net Charge0
Average Mass335.488
Monoisotopic Mass335.24604
SMILES[H]OC(=O)[C@@]([H])(C([H])([H])[H])[C@@]([H])(N([H])[H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[H])C([H])([H])[C@]([H])(C([H])([H])[H])[C@@]([H])(OC([H])([H])[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C20H33NO3/c1-14(10-11-18(21)16(3)20(22)23)12-15(2)19(24-4)13-17-8-6-5-7-9-17/h5-9,14-16,18-19H,10-13,21H2,1-4H3,(H,22,23)/t14-,15+,16+,18+,19+/m1/s1
InChIKeySWTFXINHZPXNOX-DZBHQSCQSA-N
ChEBI Ontology
Outgoing Relation(s)
2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-9-METHOXYNONANOIC ACID (CHEBI:40593) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-9-METHOXYNONANOIC ACIDPDBeChem
(2S,3S,6R,8S,9S)-3-amino-9-methoxy-2,6,8-trimethyl-10-phenyldecanoic acidPDBeChem
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