Vitas-M small molecule compound
N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(2-hydroxy-4-methylquinolin-7-yl)isoleucinamide
Catalog ID
STL549680
SMILES CCC(C(C(=O)Nc1ccc2c(c1)nc(cc2C)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C37H42N4O7 MW 654.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H42N4O7/c1-8-19(2)34(37(45)39-23-10-11-24-20(3)15-32(44)40-29(24)17-23)41-28-14-12-25-26(18-30(28)43)27(38-21(4)42)13-9-22-16-31(46-5)35(47-6)36(48-7)33(22)25/h10-12,14-19,27,34H,8-9,13H2,1-7H3,(H,38,42)(H,39,45)(H,40,44)(H,41,43)InChIKey
QVKRTEHTNIZPML-UHFFFAOYSA-NSynonyms
132286035
2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methyl~(N)(4methyl2oxo1~(H)quinolin7yl)pentanamide
InChI=1SC37H42N4O7c1819(2)34(37(45)392310112420(3)1532(44)4029(24)1723)412814122526(1830(28)43)27(3821(4)42)139221631(465)35(476)36(487)33(22)25h101214192734H8913H217H3(H3842)(H3945)(H4044)(H4143)
MFCD31757137
N~2~(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2hydroxy4methylquinolin7yl)isoleucinamide
ZINC000888089248
ZINC000888089251
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