Vitas-M small molecule compound

(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 3-methyl-4-(3-methylphenyl)butanoate

Catalog ID
STL562137
SMILES CC(Cc1cccc(c1)C)CC(=O)OC[C@@H]1CCCN2[C@@H]1CCCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H33NO2 MW 343.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H33NO2/c1-17-7-5-8-19(13-17)14-18(2)15-22(24)25-16-20-9-6-12-23-11-4-3-10-21(20)23/h5,7-8,13,18,20-21H,3-4,6,9-12,14-16H2,1-2H3/t18?,20-,21+/m0/s1
InChIKey
AQCXSWOGSGUXKS-QYAPWVIVSA-N
Synonyms
956815-40-0
((1R9aR)23467899aoctahydro1Hquinolizin1yl)methyl3methyl4(3methylphenyl)butanoate
((1R9aR)octahydro1Hquinolizin1yl)methyl3methyl4(mtolyl)butanoate
(1R9aR)octahydro2Hquinolizin1ylmethyl3methyl4(3methylphenyl)butanoate
16396733
956815400
CC(Cc1cccc(c1)C)CC(=O)OC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC22H33NO2c11775819(1317)1418(2)1522(24)25162096122311431021(20)23h57813182021H3469121416H212H3t18?2021+m0s1
MFCD32651179
ZINC000004027954
ZINC000004027955

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Available files

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