Vitas-M small molecule compound

5'-O-[bis(4-methoxyphenyl)(phenyl)methyl]-N-[(4-tert-butylphenoxy)acetyl]-2'-O-ethylcytidine

Catalog ID
STK329891
SMILES CCO[C@@H]1[C@H](O)[C@H](O[C@H]1n1ccc(nc1=O)NC(=O)COc1ccc(cc1)C(C)(C)C)COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1

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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 C44H49N3O9 MW 763.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H49N3O9/c1-7-53-40-39(49)36(56-41(40)47-26-25-37(46-42(47)50)45-38(48)28-54-35-23-13-29(14-24-35)43(2,3)4)27-55-44(30-11-9-8-10-12-30,31-15-19-33(51-5)20-16-31)32-17-21-34(52-6)22-18-32/h8-26,36,39-41,49H,7,27-28H2,1-6H3,(H,45,46,48,50)/t36-,3
InChIKey
MJHQXCDGXASRNA-OGEJDOPKSA-N
Synonyms

5O(bis(4methoxyphenyl)(phenyl)methyl)N((4tertbutylphenoxy)acetyl)2Oethylcytidine
CCO(C@@H)1(C@H)(O)(C@H)(O(C@H)1n1ccc(nc1=O)NC(=O)COc1ccc(cc1)C(C)(C)C)COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1
CCOC1C(C(OC1N2C=CC(=NC2=O)NC(=O)COC3=CC=C(C=C3)C(C)(C)C)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O
InChI=1SC44H49N3O9c17534039(49)36(5641(40)47262537(4642(47)50)4538(48)285435231329(142435)43(23)4)275544(30119810123031151933(515)201631)32172134(526)221832h82636394149H72728H216H3(H45464850)t36394041m1s1
MFCD09962094
N(1((2R3R4R5R)5((bis(4methoxyphenyl)phenylmethoxy)methyl)3ethoxy4hydroxyoxolan2yl)2oxopyrimidin4yl)2(4tertbutylphenoxy)acetamide
ZINC000150388066
ZINC150388066

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Available files

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