Vitas-M small molecule compound
2-(6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-7-en-2-yl)phenyl propanoate
Catalog ID
STK014796
SMILES CCC(=O)Oc1ccccc1C1OCC2C(C1C(=CC2C)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 C20H26O3 MW 314.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26O3/c1-5-18(21)23-17-9-7-6-8-15(17)20-19-13(3)10-12(2)16(11-22-20)14(19)4/h6-10,12,14,16,19-20H,5,11H2,1-4H3InChIKey
JIMCKQMOIJWJJV-UHFFFAOYSA-NSynonyms
(2(249TRIMETHYL7OXABICYCLO(331)NON3EN6YL)PHENYL)PROPANOATE
2((1S2S5S6R9R)689TRIMETHYL3OXABICYCLO(331)NON7EN2YL)PHENYLPROPANOATE
2((5S6S9S)689trimethyl3oxabicyclo(331)non7en2yl)phenylpropionate
2(689TRIMETHYL3OXABICYCLO(331)NON7EN2YL)PHENYLPROPANOATE
CCC(=O)OC1=CC=CC=C1C2C3C(C(CO2)C(C=C3C)C)C
CCC(=O)Oc1ccccc1C1OC(C@@H)2(C@@H)(C1C(=CC2C)C)C
CCC(=O)Oc1ccccc1C1OCC2C(C1C(=CC2C)C)C
InChI=1SC20H26O3c1518(21)2317976815(17)201913(3)1012(2)16(112220)14(19)4h6101214161920H511H214H3
MFCD01844710
STK014796
ZINC000100641709
ZINC000239121124
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