(1R,2R,3S,5S)-Methyl 3-((3-(Benzyloxy)benzoyl)oxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

CAS: 168418-62-0

Rif. TR-M168415

Informazioni sul prodotto

• Nome: (1R,2R,3S,5S)-Methyl 3-((3-(Benzyloxy)benzoyl)oxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
• Sinonimi: methyl (1R,2R,3S,5S)-8-methyl-3-(3-phenylmethoxybenzoyl)oxy-8-azabicyclo[3.2.1]octane-2-carboxylate
• CAS: 168418-62-0

Descrizione

Applications (1R,2R,3S,5S)-Methyl 3-((3-(Benzyloxy)benzoyl)oxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate is an intermediate in the synthesis of meta-Hydroxybenzoylecgonine (H808550), which is a major metabolite of Cocaine (HCl: C633500). It’s presence in infant meconium analysis indicates that the infant was exposed to Cocaine, causing long term effects on infant cognition, and language development.
References Minnes, S., et al.: Arch. Women. Ment. Health, 11, 181 (2008); Lewis, B., et al.: Neuro. Tera., 33, 17 (2011); Singer, L., et al.: Neuro. Tera., 22, 653 (2000)

• Marchio: TRC

Proprietà chimiche

• Peso molecolare: 409.475
• Formula: C₂₄H₂₇NO₅
• Colore/Forma: Neat
• InChI: InChI=1S/C24H27NO5/c1-25-18-11-12-20(25)22(24(27)28-2)21(14-18)30-23(26)17-9-6-10-19(13-17)29-15-16-7-4-3-5-8-16/h3-10,13,18,20-22H,11-12,14-15H2,1-2H3/t18-,20+,21-,22+/m0/s1
• InChI key: InChIKey=LMJGVFLNQVOETP-WSWWRLHASA-N
• SMILES: COC(=O)[C@H]1[C@@H](OC(=O)c2cccc(OCc3ccccc3)c2)C[C@@H]2CC[C@H]1N2C