Vitas-M small molecule compound
4-amino-1-[(3xi)-2-deoxy-3,5-bis-O-(phenylcarbonyl)-beta-D-glycero-pentofuranosyl]-5-methylpyrimidin-2(1H)-one
Catalog ID
STK693641
SMILES O=C(c1ccccc1)OC[C@H]1O[C@H](CC1OC(=O)c1ccccc1)n1cc(C)c(nc1=O)N
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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 C24H23N3O6 MW 449.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O6/c1-15-13-27(24(30)26-21(15)25)20-12-18(33-23(29)17-10-6-3-7-11-17)19(32-20)14-31-22(28)16-8-4-2-5-9-16/h2-11,13,18-20H,12,14H2,1H3,(H2,25,26,30)/t18?,19-,20-/m1/s1InChIKey
NCTJUBXGPJXNME-FXJNCMGBSA-NSynonyms
((2R5R)5(4amino5methyl2oxopyrimidin1yl)3benzoyloxyoxolan2yl)methylbenzoate
4amino1((3xi)2deoxy35bisO(phenylcarbonyl)betaDglyceropentofuranosyl)5methylpyrimidin2(1H)one
CC1=CN(C(=O)N=C1N)C2CC(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4
InChI=1SC24H23N3O6c1151327(24(30)2621(15)25)201218(3323(29)17106371117)19(3220)143122(28)168425916h211131820H1214H21H3(H2252630)t18?1920m1s1
MFCD18169451
O=C(c1ccccc1)OC(C@H)1O(C@H)(CC1OC(=O)c1ccccc1)n1cc(C)c(nc1=O)N
ZINC000015107665
ZINC000015107669
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