Vitas-M small molecule compound
methyl 1-{N-[(5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)carbonyl]-L-valyl}piperidine-4-carboxylate
Catalog ID
STL009275
SMILES COC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
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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 C25H31N3O7 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O7/c1-5-27-12-17(22(29)16-10-19-20(11-18(16)27)35-13-34-19)23(30)26-21(14(2)3)24(31)28-8-6-15(7-9-28)25(32)33-4/h10-12,14-15,21H,5-9,13H2,1-4H3,(H,26,30)/t21-/m0/s1InChIKey
HEAKALRHIHHYHR-NRFANRHFSA-NSynonyms
1014086-57-7(S)methyl1(2(5ethyl8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamido)3methylbutanoyl)piperidine4carboxylate
1014086577
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C(C)C)C(=O)N4CCC(CC4)C(=O)OC
COC(=O)C1CCN(CC1)C(=O)(C@H)(C(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC25H31N3O7c15271217(22(29)16101920(1118(16)27)35133419)23(30)2621(14(2)3)24(31)288615(7928)25(32)334h1012141521H5913H214H3(H2630)t21m0s1
methyl1((2S)2((5ethyl8oxo(13)dioxolo(45g)quinoline7carbonyl)amino)3methylbutanoyl)piperidine4carboxylate
methyl1(N((5ethyl8oxo58dihydro(13)dioxolo(45g)quinolin7yl)carbonyl)Lvalyl)piperidine4carboxylate
MFCD08748114
ZINC000009340382
ZINC09340382
ZINC9340382
Check stock
See real-time availability and sample size for STL009275 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.