Vitas-M small molecule compound
3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)ethyl]propanamide
Catalog ID
STL550377
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)N[C@H](c1nc2c(n1C)cccc2)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 C26H27N3O6 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6/c1-14-11-21(31)24(33)25(35-14)17(16-9-10-20(30)22(12-16)34-4)13-23(32)27-15(2)26-28-18-7-5-6-8-19(18)29(26)3/h5-12,15,17,30,33H,13H2,1-4H3,(H,27,32)/t15-,17?/m0/s1InChIKey
FMVODFOGQNWICW-MYJWUSKBSA-NSynonyms
127252817
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((1S)1(1methyl1Hbenzimidazol2yl)ethyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((S)1(1methyl1Hbenzo(d)imidazol2yl)ethyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)~(N)((1~(S))1(1methylbenzimidazol2yl)ethyl)propanamide
COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)N(C@H)(c1nc2c(n1C)cccc2)C
InChI=1SC26H27N3O6c1141121(31)24(33)25(3514)17(1691020(30)22(1216)344)1323(32)2715(2)262818756819(18)29(26)3h51215173033H13H214H3(H2732)t1517?m0s1
ZINC000604404360
ZINC000604404363
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