Vitas-M small molecule compound

(3R,4R,6S,7S,9S,10Z,12R,13R)-6-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-10-(hydroxyimino)-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecan-2

Catalog ID
STL263240
SMILES O/N=C\1/[C@@H](C)C[C@](C)(O)[C@@H](OC2OC(C)CC(C2O)N(C)C)C(C)[C@@H](OC2CC(C)(OC)C(C(O2)C)O)[C@H](C(=O)OC([C@]([C@H](C1C)O)(C)O)CC)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 C37H68N2O13 MW 748.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H68N2O13/c1-14-25-37(10,45)30(41)20(4)27(38-46)18(2)16-35(8,44)32(52-34-28(40)24(39(11)12)15-19(3)48-34)21(5)29(22(6)33(43)50-25)51-26-17-36(9,47-13)31(42)23(7)49-26/h18-26,28-32,34,40-42,44-46H,14-17H2,1-13H3/b38-27-/t18-,19?,20?,21?,22+,23?,
InChIKey
KYTWXIARANQMCA-ITVPWTAKSA-N
Synonyms

(3R4R6S7S9S10Z12R13R)6((4(dimethylamino)3hydroxy6methyltetrahydro2Hpyran2yl)oxy)14ethyl71213trihydroxy10(hydroxyimino)4((5hydroxy4methoxy46dimethyltetrahydro2Hpyran
MFCD03258944
ON=C1(C@@H)(C)C(C@)(C)(O)(C@@H)(OC2OC(C)CC(C2O)N(C)C)C(C)(C@@H)(OC2CC(C)(OC)C(C(O2)C)O)(C@H)(C(=O)OC((C@)((C@H)(C1C)O)(C)O)CC)C
ON=C1(C@H)(C)C(C@@)(C)(O)(C@H)(OC2O(C@H)(C)C(C@@H)((C@H)2O)N(C)C)(C@@H)(C)(C@H)(OC2C(C@)(C)(OC)(C@@H)((C@H)(O2)C)O)(C@H)(C(=O)O(C@@H)((C@@)((C@@H)((C@H)1C)O)(C)O)CC)C
ZINC000245310994
ZINC000245310997

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Available files

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