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-(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)propanamide
Catalog ID
STL546211
SMILES NC(=O)CC(c1cc2cccc3c2n(c1=O)CCC3)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 C32H32N4O6 MW 568.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O6/c33-27(38)13-23(24-11-20-5-1-4-19-6-3-9-35(29(19)20)32(24)41)31-30(40)26(37)12-22(42-31)17-34-14-18-10-21(16-34)25-7-2-8-28(39)36(25)15-18/h1-2,4-5,7-8,11-12,18,21,23,40H,3,6,9-10,13-17H2,(H2,33,38)/t18-,21+,23?/m0/s1InChIKey
HDDKOEVNZXYJCH-ZBUVYOTDSA-NSynonyms
3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)3(3oxo3567tetrahydropyrido(321ij)quinolin2yl)propanamide
3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)3(5oxo23dihydro1H5Hpyrido(321ij)quinolin6yl)propanamide
InChI=1SC32H32N4O6c3327(38)1323(2411205141963935(29(19)20)32(24)41)3130(40)26(37)1222(4231)173414181021(1634)2572828(39)36(25)1518h124578111218212340H369101317H2(H23338)t1821+23?m0s1
NC(=O)CC(c1cc2cccc3c2n(c1=O)CCC3)c1oc(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O
ZINC000409413748
ZINC000409413751
Check stock
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Check stock on Vitas-MAvailable files
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