Vitas-M small molecule compound
(3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyl-N-[2-(pentyloxy)phenyl]tetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name)
Catalog ID
STL553688
SMILES CCCCCOc1ccccc1NC(=O)[C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(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 C23H33NO7 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33NO7/c1-6-7-10-13-26-15-12-9-8-11-14(15)24-20(25)18-16-17(29-22(2,3)28-16)19-21(27-18)31-23(4,5)30-19/h8-9,11-12,16-19,21H,6-7,10,13H2,1-5H3,(H,24,25)/t16-,17+,18+,19-,21-/m1/s1InChIKey
HLGFEKDHPNYQTH-WVXKDWSHSA-NSynonyms
447458-27-7(1~(S)2~(R)6~(R)8~(S)9~(R))441111tetramethyl~(N)(2pentoxyphenyl)3571012pentaoxatricyclo(7300^(26))dodecane8carboxamide
(3aR5S5aR8aS8bR)2277tetramethylN(2(pentyloxy)phenyl)tetrahydro3aHbis((13)dioxolo)(45b45d)pyran5carboxamide
(3aR5S5aR8aS8bR)2277tetramethylN(2(pentyloxy)phenyl)tetrahydro3aHbis(13)dioxolo(45b45d)pyran5carboxamide(nonpreferredname)
16397391
447458277
CCCCCOc1ccccc1NC(=O)(C@H)1O(C@@H)2OC(O(C@@H)2(C@@H)2(C@H)1OC(O2)(C)C)(C)C
InChI=1SC23H33NO7c1671013261512981114(15)2420(25)181617(2922(23)2816)1921(2718)3123(45)3019h891112161921H671013H215H3(H2425)t1617+18+1921m1s1
MFCD02129548
ZINC000008964465
ZINC8964465
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