Vitas-M small molecule compound
3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[2-(methoxymethyl)-1H-benzimidazol-5-yl]-3-(2,3,4-trimethoxyphenyl)propanamide
Catalog ID
STL550099
SMILES COCc1nc2c([nH]1)ccc(c2)NC(=O)CC(c1c(O)cc(oc1=O)C)c1ccc(c(c1OC)OC)OC
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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 C27H29N3O8 MW 523.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O8/c1-14-10-20(31)24(27(33)38-14)17(16-7-9-21(35-3)26(37-5)25(16)36-4)12-23(32)28-15-6-8-18-19(11-15)30-22(29-18)13-34-2/h6-11,17,31H,12-13H2,1-5H3,(H,28,32)(H,29,30)InChIKey
XVTQGXMRUKLNSL-UHFFFAOYSA-NSynonyms
129895482
3(4hydroxy6methyl2oxo2Hpyran3yl)N(2(methoxymethyl)1Hbenzimidazol5yl)3(234trimethoxyphenyl)propanamide
3(4hydroxy6methyl2oxo2Hpyran3yl)N(2(methoxymethyl)1Hbenzo(d)imidazol6yl)3(234trimethoxyphenyl)propanamide
3(4hydroxy6methyl2oxopyran3yl)~(N)(2(methoxymethyl)3~(H)benzimidazol5yl)3(234trimethoxyphenyl)propanamide
COCc1(nH)c2c(n1)ccc(c2)NC(=O)CC(c1c(O)cc(oc1=O)C)c1ccc(c(c1OC)OC)OC
InChI=1SC27H29N3O8c1141020(31)24(27(33)3814)17(167921(353)26(375)25(16)364)1223(32)2815681819(1115)3022(2918)13342h6111731H1213H215H3(H2832)(H2930)
MFCD31757393
ZINC000524731435
ZINC000524731436
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