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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(2-methoxybenzyl)-L-methioninamide

Catalog ID
STL542386
SMILES CSCC[C@@H](C(=O)NCc1ccccc1OC)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)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 C34H41N3O7S MW 635.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H41N3O7S/c1-20(38)36-25-13-11-21-17-30(42-3)32(43-4)33(44-5)31(21)23-12-14-26(28(39)18-24(23)25)37-27(15-16-45-6)34(40)35-19-22-9-7-8-10-29(22)41-2/h7-10,12,14,17-18,25,27H,11,13,15-16,19H2,1-6H3,(H,35,40)(H,36,38)(H,37,39)/t25-,27-/m0/s1
InChIKey
YUJMRXKTFPXVOE-BDYUSTAISA-N
Synonyms
1574390-19-4
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((2methoxyphenyl)methyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2methoxybenzyl)4(methylthio)butanamide
1574390194
75491766
CSCC(C@@H)(C(=O)NCc1ccccc1OC)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC34H41N3O7Sc120(38)36251311211730(423)32(434)33(445)31(21)23121426(28(39)1824(23)25)3727(1516456)34(40)3519229781029(22)412h710121417182527H1113151619H216H3(H3540)(H3638)(H3739)t2527m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2methoxybenzyl)Lmethioninamide
ZINC000108449494
ZINC108449494

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Available files

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

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