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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-(3,4-dimethoxyphenyl)ethyl]-L-methioninamide

Catalog ID
STL542464
SMILES CSCC[C@@H](C(=O)NCCc1ccc(c(c1)OC)OC)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 C36H45N3O8S MW 679.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H45N3O8S/c1-21(40)38-26-11-9-23-19-32(45-4)34(46-5)35(47-6)33(23)24-10-12-27(29(41)20-25(24)26)39-28(15-17-48-7)36(42)37-16-14-22-8-13-30(43-2)31(18-22)44-3/h8,10,12-13,18-20,26,28H,9,11,14-17H2,1-7H3,(H,37,42)(H,38,40)(H,39,41)/t26-,28-/m0/s1
InChIKey
IQOWJDCCYLFZIM-XCZPVHLTSA-N
Synonyms
1574291-50-1
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(34dimethoxyphenyl)ethyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(34dimethoxyphenethyl)4(methylthio)butanamide
1574291501
75490978
CSCC(C@@H)(C(=O)NCCc1ccc(c(c1)OC)OC)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H45N3O8Sc121(40)3826119231932(454)34(465)35(476)33(23)24101227(29(41)2025(24)26)3928(1517487)36(42)3716142281330(432)31(1822)443h810121318202628H9111417H217H3(H3742)(H3840)(H3941)t2628m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(34dimethoxyphenyl)ethyl)Lmethioninamide
ZINC000150652945
ZINC150652945

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Available files

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