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N-[5-(acetylamino)-2-methoxyphenyl]-4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}butanamide

Catalog ID
STL544198
SMILES COc1ccc(cc1NC(=O)CCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)NC(=O)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 C34H40N4O8 MW 632.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40N4O8/c1-19(39)36-22-10-14-29(43-3)27(17-22)38-31(42)8-7-15-35-26-13-11-23-24(18-28(26)41)25(37-20(2)40)12-9-21-16-30(44-4)33(45-5)34(46-6)32(21)23/h10-11,13-14,16-18,25H,7-9,12,15H2,1-6H3,(H,35,41)(H,36,39)(H,37,40)(H,38,42)/t25-/m0/s1
InChIKey
PTKOITGSJBSWRO-VWLOTQADSA-N
Synonyms

(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(5acetamido2methoxyphenyl)butanamide
~(N)(5acetamido2methoxyphenyl)4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)butanamide
110206160
COc1ccc(cc1NC(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)NC(=O)C
InChI=1SC34H40N4O8c119(39)3622101429(433)27(1722)3831(42)8715352613112324(1828(26)41)25(3720(2)40)129211630(444)33(455)34(466)32(21)23h10111314161825H791215H216H3(H3541)(H3639)(H3740)(H3842)t25m0s1
N(5(acetylamino)2methoxyphenyl)4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanamide
ZINC000253412070
ZINC253412070

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Available files

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

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