Vitas-M small molecule compound
(4-hexyl-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl)methyl acetate
Catalog ID
STL560911
SMILES CCCCCCC1OCC2(C(C1C(=CC2C)C)C)COC(=O)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 C20H34O3 MW 322.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H34O3/c1-6-7-8-9-10-18-19-14(2)11-15(3)20(13-23-18,16(19)4)12-22-17(5)21/h11,15-16,18-19H,6-10,12-13H2,1-5H3InChIKey
AJARVPVQKHTUGJ-UHFFFAOYSA-NSynonyms
((1S5R9R)4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylacetate
(4hexyl689trimethyl3oxabicyclo(331)non6en1yl)methylacetate
3517459
CCCCCCC1OC(C@)2(C((C@@H)1C(=CC2C)C)C)COC(=O)C
InChI=1SC20H34O3c1678910181914(2)1115(3)20(13231816(19)4)122217(5)21h1115161819H6101213H215H3
MFCD01025652
ZINC000102968977
ZINC000250794602
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