Catalog Number:
AG003QZ9
Chemical Name:
(S)-endo-8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate sulfate(2:1)
CAS Number:
620-61-1
Molecular Formula:
C34H48N2O10S
Molecular Weight:
676.8173
MDL Number:
MFCD00078244
IUPAC Name:
[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate;sulfuric acid
InChI:
InChI=1S/2C17H23NO3.H2O4S/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4)/t2*13-,14+,15?,16-;/m11./s1
InChI Key:
HOBWAPHTEJGALG-LFQBMQRVSA-N
SMILES:
OS(=O)(=O)O.OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C.OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C
EC Number:
210-644-6
UNII:
OB570Z127K
