Vitas-M small molecule compound
5-ethyl-N-{(2S)-1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxopropan-2-yl}-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK612708
SMILES OCC(NC(=O)[C@@H](NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)C)Cc1ccccc1
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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 C25H27N3O6 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6/c1-3-28-12-19(23(30)18-10-21-22(11-20(18)28)34-14-33-21)25(32)26-15(2)24(31)27-17(13-29)9-16-7-5-4-6-8-16/h4-8,10-12,15,17,29H,3,9,13-14H2,1-2H3,(H,26,32)(H,27,31)/t15-,17?/m0/s1InChIKey
GUTWVNVGJXQLRT-MYJWUSKBSA-NSynonyms
5ethylN((2S)1((1hydroxy3phenylpropan2yl)amino)1oxopropan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1((1hydroxy3phenylpropan2yl)amino)1oxopropan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C)C(=O)NC(CC4=CC=CC=C4)CO
InChI=1SC25H27N3O6c13281219(23(30)18102122(1120(18)28)34143321)25(32)2615(2)24(31)2717(1329)9167546816h481012151729H391314H212H3(H2632)(H2731)t1517?m0s1
MFCD08292262
OCC(NC(=O)(C@@H)(NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)C)Cc1ccccc1
ZINC000009435839
ZINC000009435840
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