Vitas-M small molecule compound
2-(3,4-dimethoxyphenyl)-2-oxoethyl tricyclo[3.3.1.1~3,7~]decane-1-carboxylate
Catalog ID
STL252702
SMILES COc1cc(ccc1OC)C(=O)COC(=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 C21H26O5 MW 358.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26O5/c1-24-18-4-3-16(8-19(18)25-2)17(22)12-26-20(23)21-9-13-5-14(10-21)7-15(6-13)11-21/h3-4,8,13-15H,5-7,9-12H2,1-2H3InChIKey
DUNFBEDQOMZOFB-UHFFFAOYSA-NSynonyms
(2(34DIMETHOXYPHENYL)2OXOETHYL)ADAMANTANE1CARBOXYLATE
2(34dimethoxyphenyl)2oxoethyltricyclo(3311~37~)decane1carboxylate
COC1=C(C=C(C=C1)C(=O)COC(=O)C23CC4CC(C2)CC(C4)C3)OC
InChI=1SC21H26O5c124184316(819(18)252)17(22)122620(23)21913514(1021)715(613)1121h3481315H57912H212H3
ZINC000005126922
ZINC5126922
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