Vitas-M small molecule compound
(2R,3R,4S,5R,6S)-2-(acetoxymethyl)-6-(4-(2-(4-chlorophenyl)acetyl)-3-hydroxyphenoxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate
Catalog ID
STL565415
SMILES CC(=O)OCC1O[C@@H](Oc2ccc(c(c2)O)C(=O)Cc2ccc(cc2)Cl)C(C([C@H]1OC(=O)C)OC(=O)C)OC(=O)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 C28H29ClO12 MW 592.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClO12/c1-14(30)36-13-24-25(37-15(2)31)26(38-16(3)32)27(39-17(4)33)28(41-24)40-20-9-10-21(23(35)12-20)22(34)11-18-5-7-19(29)8-6-18/h5-10,12,24-28,35H,11,13H2,1-4H3/t24?,25-,26?,27?,28-/m1/s1InChIKey
JWTWVAVUQMMSIC-HQXNIROVSA-NSynonyms
((3R6S)345triacetyloxy6(4(2(4chlorophenyl)acetyl)3hydroxyphenoxy)oxan2yl)methylacetate
(2R3R4S5R6S)2(acetoxymethyl)6(4(2(4chlorophenyl)acetyl)3hydroxyphenoxy)tetrahydro2Hpyran345triyltriacetate
25088379
CC(=O)OCC1O(C@@H)(Oc2ccc(c(c2)O)C(=O)Cc2ccc(cc2)Cl)C(C((C@@H)1OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC28H29ClO12c114(30)36132425(3715(2)31)26(3816(3)32)27(3917(4)33)28(4124)402091021(23(35)1220)22(34)11185719(29)8618h51012242835H1113H214H3t24?2526?27?28m1s1
MFCD01543940
ZINC000070664694
ZINC000102804371
Check stock
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Check stock on Vitas-MAvailable files
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