Vitas-M small molecule compound
(R)-2-((2S,3S)-2-((S)-2-isopropyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxamido)-3-methylpentanamido)-3-methylbutanoic acid
Catalog ID
STL536859
SMILES CCC([C@@H](C(=O)N[C@@H](C(=O)O)C(C)C)NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)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 C23H34N4O5 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N4O5/c1-7-14(6)18(20(28)25-17(12(2)3)22(30)31)26-23(32)27-16-11-9-8-10-15(16)24-21(29)19(27)13(4)5/h8-14,17-19H,7H2,1-6H3,(H,24,29)(H,25,28)(H,26,32)(H,30,31)/t14?,17-,18+,19+/m1/s1InChIKey
VUXYGWVIHPLBTM-JICJKYNPSA-NSynonyms
956971-00-9(2~(R))3methyl2(((2~(S))3methyl2(((2~(S))3oxo2propan2yl24dihydroquinoxaline1carbonyl)amino)pentanoyl)amino)butanoicacid
(R)2((2S3S)2((S)2isopropyl3oxo1234tetrahydroquinoxaline1carboxamido)3methylpentanamido)3methylbutanoicacid
16407219
956971009
CCC((C@@H)(C(=O)N(C@@H)(C(=O)O)C(C)C)NC(=O)N1(C@@H)(C(C)C)C(=O)Nc2c1cccc2)C
InChI=1SC23H34N4O5c1714(6)18(20(28)2517(12(2)3)22(30)31)2623(32)271611981015(16)2421(29)19(27)13(4)5h8141719H7H216H3(H2429)(H2528)(H2632)(H3031)t14?1718+19+m1s1
MFCD08283911
ZINC000012891046
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