SpectraBase Spectrum ID |
ADPCSbnj5cb |
Name |
1-Piperidinecarboxylic acid, 2-methyl-6-[3-[[(phenylmethoxy)carbonyl]oxy]heptyl]-, phenylmethyl ester, [2.alpha.,6.alpha.(S*)]-(.+-.)- |
CAS Registry Number |
122045-84-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H39NO5 |
InChI |
InChI=1S/C29H39NO5/c1-3-4-18-27(35-29(32)34-22-25-15-9-6-10-16-25)20-19-26-17-11-12-23(2)30(26)28(31)33-21-24-13-7-5-8-14-24/h5-10,13-16,23,26-27H,3-4,11-12,17-22H2,1-2H3/t23-,26+,27+/m0/s1 |
InChIKey |
AEXIYFQDMZYPQL-HUROMRQRSA-N |
Molecular Weight |
481.633 g/mol |
SMILES |
C(N1[C@@](CC[C@](OC(=O)OCc2ccccc2)(CCCC)[H])(CCC[C@@]1(C)[H])[H])(OCc1ccccc1)=O |
SPLASH |
splash10-000f-9600000000-9a430d0961f523772208 |
Source of Spectrum |
J-54-4095-43 |
Synonyms |
benzyl (2R,6S)-2-((3R)-3-{[(benzyloxy)carbonyl]oxy}heptyl)-6-methyl-1-piperidinecarboxylate
rel-[2s,6S,2(3R)]-N-[(benzyloxy)carbonyl]-2-[3-[[(benzyloxy)carbonyl]oxy]heptyl]-6-methylpiperidine |
Wiley ID |
1395437 |