Vitas-M small molecule compound
(3aR,5aR,8aS,8bR)-N-{2-[(4-methoxy-2-nitrophenyl)amino]-2-oxoethyl}-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name)
Catalog ID
STL526343
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)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 C21H27N3O10 MW 481.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O10/c1-20(2)31-14-15(32-20)17-19(34-21(3,4)33-17)30-16(14)18(26)22-9-13(25)23-11-7-6-10(29-5)8-12(11)24(27)28/h6-8,14-17,19H,9H2,1-5H3,(H,22,26)(H,23,25)/t14-,15+,16?,17-,19-/m1/s1InChIKey
GWUWDJLWRPSZHT-XTMPTPMBSA-NSynonyms
1029693-14-8(1~(S)2~(R)6~(R)9~(R))~(N)(2(4methoxy2nitroanilino)2oxoethyl)441111tetramethyl3571012pentaoxatricyclo(7300^(26))dodecane8carboxamide
(3aR5aR8aS8bR)N(2((4methoxy2nitrophenyl)amino)2oxoethyl)2277tetramethyltetrahydro3aHbis((13)dioxolo)(45b45d)pyran5carboxamide
(3aR5aR8aS8bR)N(2((4methoxy2nitrophenyl)amino)2oxoethyl)2277tetramethyltetrahydro3aHbis(13)dioxolo(45b45d)pyran5carboxamide(nonpreferredname)
1029693148
16397299
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)CNC(=O)C1O(C@@H)2OC(O(C@@H)2(C@@H)2(C@H)1OC(O2)(C)C)(C)C
InChI=1SC21H27N3O10c120(2)311415(3220)1719(3421(34)3317)3016(14)18(26)22913(25)23117610(295)812(11)24(27)28h68141719H9H215H3(H2226)(H2325)t1415+16?1719m1s1
MFCD02925772
ZINC000012660335
ZINC000012660338
Check stock
See real-time availability and sample size for STL526343 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.