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-(1H-indol-1-yl)ethyl]glycinamide

Catalog ID
STL540587
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)NCCn2ccc3c2cccc3)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 C33H36N4O6 MW 584.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N4O6/c1-20(38)36-25-11-9-22-17-29(41-2)32(42-3)33(43-4)31(22)23-10-12-26(28(39)18-24(23)25)35-19-30(40)34-14-16-37-15-13-21-7-5-6-8-27(21)37/h5-8,10,12-13,15,17-18,25H,9,11,14,16,19H2,1-4H3,(H,34,40)(H,35,39)(H,36,38)/t25-/m0/s1
InChIKey
ZMYWDFJQBWNAQU-VWLOTQADSA-N
Synonyms
1574345-40-6
(S)N(2(1Hindol1yl)ethyl)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)acetamide
1574345406
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2indol1ylethyl)acetamide
75492230
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)NCCn2ccc3c2cccc3)NC(=O)C)cc(c1OC)OC
InChI=1SC33H36N4O6c120(38)3625119221729(412)32(423)33(434)31(22)23101226(28(39)1824(23)25)351930(40)34141637151321756827(21)37h5810121315171825H911141619H214H3(H3440)(H3539)(H3638)t25m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hindol1yl)ethyl)glycinamide
ZINC000108450587
ZINC108450587

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.