Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(2-hydroxy-3-oxo-3,4-dihydroquinoxalin-6-yl)valinamide
Catalog ID
STL547858
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC(C(=O)Nc2ccc3c(c2)[nH]c(=O)c(n3)O)C(C)C)NC(=O)C)cc(c1OC)OC
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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 C34H37N5O8 MW 643.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N5O8/c1-16(2)29(32(42)36-19-8-11-23-25(14-19)39-34(44)33(43)38-23)37-24-12-9-20-21(15-26(24)41)22(35-17(3)40)10-7-18-13-27(45-4)30(46-5)31(47-6)28(18)20/h8-9,11-16,22,29H,7,10H2,1-6H3,(H,35,40)(H,36,42)(H,37,41)(H,38,43)(H,39,44)/t22-,29?/mInChIKey
OGDCRKUWCPHUKT-RBQQCVMASA-NSynonyms
122169700
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(23dioxo14dihydroquinoxalin6yl)3methylbutanamide
InChI=1SC34H37N5O8c116(2)29(32(42)36198112325(1419)3934(44)33(43)3823)37241292021(1526(24)41)22(3517(3)40)107181327(454)30(465)31(476)28(18)20h8911162229H710H216H3(H3540)(H3642)(H3741)(H3843)(H3944)t2229?m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2hydroxy3oxo34dihydroquinoxalin6yl)valinamide
ZINC000263585958
ZINC000409414789
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