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-(1-methyl-1H-pyrazol-3-yl)-L-alaninamide
Catalog ID
STL548590
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccn(n2)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 C28H33N5O6 MW 535.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N5O6/c1-15(28(36)31-24-11-12-33(3)32-24)29-21-10-8-18-19(14-22(21)35)20(30-16(2)34)9-7-17-13-23(37-4)26(38-5)27(39-6)25(17)18/h8,10-15,20H,7,9H2,1-6H3,(H,29,35)(H,30,34)(H,31,32,36)/t15-,20-/m0/s1InChIKey
YDIGOWNQNUDXNZ-YWZLYKJASA-NSynonyms
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1methylpyrazol3yl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1methyl1Hpyrazol3yl)propanamide
100002129
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccn(n2)C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC28H33N5O6c115(28(36)3124111233(3)3224)29211081819(1422(21)35)20(3016(2)34)97171323(374)26(385)27(396)25(17)18h8101520H79H216H3(H2935)(H3034)(H313236)t1520m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hpyrazol3yl)Lalaninamide
ZINC000218050928
ZINC218050928
Check stock
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Check stock on Vitas-MAvailable files
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