Vitas-M small molecule compound
(3R,4R,6S,7S,9S,12R,13R)-6-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-10-imino-3,5,7,9,11,13-hexamethyloxacyclotetradecan-2-one (non-pre
Catalog ID
STK177316
SMILES CCC1OC(=O)[C@H](C)[C@H](OC2OC(C)C(C(C2)(C)OC)O)C(C)[C@H](OC2OC(C)CC(C2O)N(C)C)[C@@](C[C@@H](C(=N)C([C@@H]([C@@]1(C)O)O)C)C)(C)O
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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 C37H68N2O12 MW 732.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H68N2O12/c1-14-25-37(10,45)30(41)20(4)27(38)18(2)16-35(8,44)32(51-34-28(40)24(39(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,38,40-42,44-45H,14-17H2,1-13H3/b38-27-/t18-,19?,20?,21?,22+,23?,InChIKey
RNDFKJXPTGJOSU-ITVPWTAKSA-NSynonyms
(3R4R6S7S9S12R13R)6((4(dimethylamino)3hydroxy6methyltetrahydro2Hpyran2yl)oxy)14ethyl71213trihydroxy4((5hydroxy4methoxy46dimethyltetrahydro2Hpyran2yl)oxy)10imino3
CC(C@H)1OC(=O)(C@H)(C)(C@H)(OC2O(C@H)(C)(C@H)((C@@)(C2)(C)OC)O)(C@@H)(C)(C@H)(OC2O(C@H)(C)C(C@@H)((C@H)2O)N(C)C)C(C(C@@H)(C(=N)C((C@H)((C@@)1(C)O)O)C)C)(C)O
CCC1OC(=O)(C@H)(C)(C@H)(OC2OC(C)C(C(C2)(C)OC)O)C(C)(C@H)(OC2OC(C)CC(C2O)N(C)C)(C@@)(C(C@@H)(C(=N)C((C@@H)((C@@)1(C)O)O)C)C)(C)O
MFCD24857412
ZINC000334157478
ZINC000334157481
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.