Vitas-M small molecule compound
2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-(2-{[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]amino}-2-oxoethyl)acetamide
Catalog ID
STL547170
SMILES CCc1cc(=O)oc2c1c(OCC(=O)NCC(=O)NCC(=O)N1CCC3(C(C1)CCCC3)O)cc(c2)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 C27H35N3O7 MW 513.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O7/c1-3-18-12-25(34)37-21-11-17(2)10-20(26(18)21)36-16-23(32)28-13-22(31)29-14-24(33)30-9-8-27(35)7-5-4-6-19(27)15-30/h10-12,19,35H,3-9,13-16H2,1-2H3,(H,28,32)(H,29,31)InChIKey
LCHGMGJQGGYDMD-UHFFFAOYSA-NSynonyms
~(N)(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethyl)2((2(4ethyl7methyl2oxochromen5yl)oxyacetyl)amino)acetamide
2((4ethyl7methyl2oxo2Hchromen5yl)oxy)N(2((2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)amino)2oxoethyl)acetamide
3771530
InChI=1SC27H35N3O7c13181225(34)37211117(2)1020(26(18)21)361623(32)281322(31)291424(33)309827(35)754619(27)1530h10121935H391316H212H3(H2832)(H2931)
MFCD31756518
ZINC000002111514
ZINC000016032559
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