Vitas-M small molecule compound
3-(3-hydroxy-4-oxo-6-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-4H-pyran-2-yl)-3-(2-hydroxyquinolin-3-yl)propanamide
Catalog ID
STL549861
SMILES NC(=O)CC(c1cc2ccccc2nc1O)c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O
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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 C29H28N4O6 MW 528.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O6/c30-25(35)11-20(21-9-17-4-1-2-5-22(17)31-29(21)38)28-27(37)24(34)10-19(39-28)15-32-12-16-8-18(14-32)23-6-3-7-26(36)33(23)13-16/h1-7,9-10,16,18,20,37H,8,11-15H2,(H2,30,35)(H,31,38)/t16-,18+,20?/m1/s1InChIKey
OMNSXYPBHKHVGR-MARPTJLWSA-NSynonyms
129895150
3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)3(2oxo1~(H)quinolin3yl)propanamide
3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)3(2hydroxyquinolin3yl)propanamide
InChI=1SC29H28N4O6c3025(35)1120(21917412522(17)3129(21)38)2827(37)24(34)1019(3928)15321216818(1432)2363726(36)33(23)1316h1791016182037H81115H2(H23035)(H3138)t1618+20?m1s1
ZINC000524730595
ZINC000524730596
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