Vitas-M small molecule compound

(3aR,5aR,8aS,8bR)-2,2,7,7-tetramethyl-N-[2-oxo-2-(phenylamino)ethyl]tetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name)

Catalog ID
STL526159
SMILES O=C(Nc1ccccc1)CNC(=O)C1O[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 C20H26N2O7 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O7/c1-19(2)26-13-14(27-19)16-18(29-20(3,4)28-16)25-15(13)17(24)21-10-12(23)22-11-8-6-5-7-9-11/h5-9,13-16,18H,10H2,1-4H3,(H,21,24)(H,22,23)/t13-,14+,15?,16-,18-/m1/s1
InChIKey
VLMQBLQREDZTPU-BJLQQYENSA-N
Synonyms
1192220-01-1
(1~(S)2~(R)6~(R)9~(R))~(N)(2anilino2oxoethyl)441111tetramethyl3571012pentaoxatricyclo(7300^(26))dodecane8carboxamide
(3aR5aR8aS8bR)2277tetramethylN(2oxo2(phenylamino)ethyl)tetrahydro3aHbis((13)dioxolo)(45b45d)pyran5carboxamide
(3aR5aR8aS8bR)2277tetramethylN(2oxo2(phenylamino)ethyl)tetrahydro3aHbis(13)dioxolo(45b45d)pyran5carboxamide(nonpreferredname)
1192220011
16397298
InChI=1SC20H26N2O7c119(2)261314(2719)1618(2920(34)2816)2515(13)17(24)211012(23)22118657911h59131618H10H214H3(H2124)(H2223)t1314+15?1618m1s1
MFCD02925768
O=C(Nc1ccccc1)CNC(=O)C1O(C@@H)2OC(O(C@@H)2(C@@H)2(C@H)1OC(O2)(C)C)(C)C
ZINC000002139597
ZINC000002139598

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Available files

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