Vitas-M small molecule compound
(1S,5S)-2-methyl-2-(3-methylbut-2-en-1-yl)-6-methylidene-4-(4-methylphenyl)-3-oxabicyclo[3.3.1]nonane
Catalog ID
STL562208
SMILES CC(=CCC1(C)OC(c2ccc(cc2)C)[C@@H]2C[C@H]1CCC2=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 C22H30O MW 310.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30O/c1-15(2)12-13-22(5)19-11-8-17(4)20(14-19)21(23-22)18-9-6-16(3)7-10-18/h6-7,9-10,12,19-21H,4,8,11,13-14H2,1-3,5H3/t19-,20-,21?,22?/m0/s1InChIKey
WKGNFUTUIDWFSK-PHZLKFDYSA-NSynonyms
(1S5S)26dimethyl2(3methylbut2en1yl)4(ptolyl)3oxabicyclo(331)non6enecompoundwith(1S5S)2methyl2(3methylbut2en1yl)6methylene4(ptolyl)3oxabicyclo(331)nonane(11)
(1S5S)2methyl2(3methylbut2en1yl)6methylidene4(4methylphenyl)3oxabicyclo(331)nonane
(1S5S)2methyl2(3methylbut2enyl)6methylidene4(4methylphenyl)3oxabicyclo(331)nonane
16396428
CC(=CCC1(C)OC(c2ccc(cc2)C)(C@H)2C(C@@H)1CC=C2C)CCC(=CCC1(C)OC(c2ccc(cc2)C)(C@H)2C(C@@H)1CCC2=C)C
InChI=1SC22H30Oc115(2)121322(5)1911817(4)20(1419)21(2322)189616(3)71018h67910121921H48111314H2135H3t192021?22?m0s1
MFCD32651203
ZINC000004027421
ZINC000004027424
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