Vitas-M small molecule compound
(3a'R,5'R,6'S,6a'R)-6'-isobutoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]
Catalog ID
STL570084
SMILES CC(CO[C@H]1[C@H](O[C@H]2[C@@H]1OC1(O2)CCCCC1)C1COC2(O1)CCCCC2)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 C22H36O6 MW 396.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36O6/c1-15(2)13-23-18-17(16-14-24-21(26-16)9-5-3-6-10-21)25-20-19(18)27-22(28-20)11-7-4-8-12-22/h15-20H,3-14H2,1-2H3/t16?,17-,18+,19-,20-/m1/s1InChIKey
DSAJOXMMUNNHIK-DGDSNLKDSA-NSynonyms
294183-73-6(3aR5R6S6aR)5(14dioxaspiro(45)decan3yl)6(2methylpropoxy)spiro(3a566atetrahydrofuro(23d)(13)dioxole21cyclohexane)
(3aR5R6S6aR)6isobutoxy5((R)14dioxaspiro(45)decan2yl)tetrahydrospiro(cyclohexane12furo(23d)(13)dioxole)
294183736
5343333
CC(CO(C@H)1(C@H)(O(C@H)2(C@@H)1OC1(O2)CCCCC1)C1COC2(O1)CCCCC2)C
InChI=1SC22H36O6c115(2)13231817(16142421(2616)95361021)252019(18)2722(2820)117481222h1520H314H212H3t16?1718+1920m1s1
MFCD32649538
ZINC000004027969
ZINC000012382332
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