Vitas-M small molecule compound
[(1R,9R)-4-hexyl-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl propan-2-ylcarbamate
Catalog ID
STL562372
SMILES CCCCCCC1OC[C@@]2([C@H](C1C(=CC2C)C)C)COC(=O)NC(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 C22H39NO3 MW 365.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H39NO3/c1-7-8-9-10-11-19-20-16(4)12-17(5)22(13-25-19,18(20)6)14-26-21(24)23-15(2)3/h12,15,17-20H,7-11,13-14H2,1-6H3,(H,23,24)/t17?,18-,19?,20?,22-/m1/s1InChIKey
ULKPKSITLDMDMJ-ZGMFOMRKSA-NSynonyms
((1R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylisopropylcarbamate((1R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylNpropan2ylcarbamate
((1R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylpropan2ylcarbamate
CCCCCCC1OC(C@@)2((C@@H)(C1C(=CC2C)C)C)COC(=O)NC(C)C
Registry IDs
MFCD01544307ZINC000100741001
ZINC000105363816
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