Vitas-M small molecule compound
5,5-dimethyl-3-{[1-(tricyclo[3.3.1.1~3,7~]dec-2-yl)ethyl]amino}cyclohex-2-en-1-one
Catalog ID
STL446445
SMILES O=C1C=C(NC(C2C3CC4CC2CC(C3)C4)C)CC(C1)(C)C
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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 C20H31NO MW 301.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31NO/c1-12(21-17-9-18(22)11-20(2,3)10-17)19-15-5-13-4-14(7-15)8-16(19)6-13/h9,12-16,19,21H,4-8,10-11H2,1-3H3InChIKey
BQZVZROLIAJWJU-UHFFFAOYSA-NSynonyms
3(1(2ADAMANTYL)ETHYLAMINO)55DIMETHYLCYCLOHEX2EN1ONE
55dimethyl3((1(tricyclo(3311~37~)dec2yl)ethyl)amino)cyclohex2en1one
CC(C1C2CC3CC(C2)CC1C3)NC4=CC(=O)CC(C4)(C)C
InChI=1SC20H31NOc112(2117918(22)1120(23)1017)1915513414(715)816(19)613h912161921H481011H213H3
ZINC000004396471
ZINC000004477892
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