Vitas-M small molecule compound
5-ethyl-N-[(2S)-1-{[2-(4-hydroxyphenyl)ethyl]amino}-3-methyl-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK606232
SMILES CCn1cc(C(=O)N[C@H](C(=O)NCCc2ccc(cc2)O)C(C)C)c(=O)c2c1cc1OCOc1c2
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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 C26H29N3O6 MW 479.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O6/c1-4-29-13-19(24(31)18-11-21-22(12-20(18)29)35-14-34-21)25(32)28-23(15(2)3)26(33)27-10-9-16-5-7-17(30)8-6-16/h5-8,11-13,15,23,30H,4,9-10,14H2,1-3H3,(H,27,33)(H,28,32)/t23-/m0/s1InChIKey
QYVXYLSBAIZXIP-QHCPKHFHSA-NSynonyms
956926-97-9(S)5ethylN(1((4hydroxyphenethyl)amino)3methyl1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1((2(4hydroxyphenyl)ethyl)amino)3methyl1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(2(4hydroxyphenyl)ethylamino)3methyl1oxobutan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
956926979
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C(C)C)C(=O)NCCC4=CC=C(C=C4)O
CCn1cc(C(=O)N(C@H)(C(=O)NCCc2ccc(cc2)O)C(C)C)c(=O)c2c1cc1OCOc1c2
InChI=1SC26H29N3O6c14291319(24(31)18112122(1220(18)29)35143421)25(32)2823(15(2)3)26(33)27109165717(30)8616h581113152330H491014H213H3(H2733)(H2832)t23m0s1
MFCD08746652
ZINC000009304414
ZINC09304414
ZINC9304414
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.