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-indol-6-yl)-L-valinamide
Catalog ID
STL541756
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccc3c(c2)n(C)cc3)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 C35H40N4O6 MW 612.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N4O6/c1-19(2)32(35(42)37-23-10-8-21-14-15-39(4)28(21)17-23)38-27-13-11-24-25(18-29(27)41)26(36-20(3)40)12-9-22-16-30(43-5)33(44-6)34(45-7)31(22)24/h8,10-11,13-19,26,32H,9,12H2,1-7H3,(H,36,40)(H,37,42)(H,38,41)/t26-,32-/m0/s1InChIKey
IMOGAEFQOGNUCG-IEWVHIKDSA-NSynonyms
1574390-65-0(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methyl~(N)(1methylindol6yl)butanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylN(1methyl1Hindol6yl)butanamide
1574390650
75491555
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccc3c(c2)n(C)cc3)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC35H40N4O6c119(2)32(35(42)372310821141539(4)28(21)1723)382713112425(1829(27)41)26(3620(3)40)129221630(435)33(446)34(457)31(22)24h8101113192632H912H217H3(H3640)(H3742)(H3841)t2632m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hindol6yl)Lvalinamide
ZINC000108448933
ZINC108448933
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.