Vitas-M small molecule compound
2-(4-ethylphenyl)-2-oxoethyl N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)valinate
Catalog ID
STK070420
SMILES CCc1ccc(cc1)C(=O)COC(=O)C(C(C)C)NC(=O)C12CC3CC(C2)CC(C1)C3
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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 C26H35NO4 MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO4/c1-4-17-5-7-21(8-6-17)22(28)15-31-24(29)23(16(2)3)27-25(30)26-12-18-9-19(13-26)11-20(10-18)14-26/h5-8,16,18-20,23H,4,9-15H2,1-3H3,(H,27,30)InChIKey
WCBYTSIBTNDSFF-UHFFFAOYSA-NSynonyms
(2(4ETHYLPHENYL)2OXOETHYL)2(ADAMANTANE1CARBONYLAMINO)3METHYLBUTANOATE
2(4ethylphenyl)2oxoethylN(tricyclo(3311~37~)dec1ylcarbonyl)valinate
CCC1=CC=C(C=C1)C(=O)COC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3
CCc1ccc(cc1)C(=O)COC(=O)C(C(C)C)NC(=O)C12CC3CC(C2)CC(C1)C3
InChI=1SC26H35NO4c14175721(8617)22(28)153124(29)23(16(2)3)2725(30)261218919(1326)1120(1018)1426h5816182023H4915H213H3(H2730)
MFCD02915922
STK070420
ZINC000004599471
ZINC000004599472
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