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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-dihydro-1,4-benzodioxin-6-yl)-L-methioninamide

Catalog ID
STL540189
SMILES CSCC[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)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 C34H39N3O8S MW 649.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N3O8S/c1-19(38)35-24-9-6-20-16-30(41-2)32(42-3)33(43-4)31(20)22-8-10-25(27(39)18-23(22)24)37-26(12-15-46-5)34(40)36-21-7-11-28-29(17-21)45-14-13-44-28/h7-8,10-11,16-18,24,26H,6,9,12-15H2,1-5H3,(H,35,38)(H,36,40)(H,37,39)/t24-,26-/m0/s1
InChIKey
FXZHLOVSOUEWCM-AHWVRZQESA-N
Synonyms
1574391-10-8
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(23dihydro14benzodioxin6yl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(23dihydrobenzo(b)(14)dioxin6yl)4(methylthio)butanamide
1574391108
75491452
CSCC(C@@H)(C(=O)Nc1ccc2c(c1)OCCO2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC34H39N3O8Sc119(38)352496201630(412)32(423)33(434)31(20)2281025(27(39)1823(22)24)3726(1215465)34(40)36217112829(1721)4514134428h78101116182426H691215H215H3(H3538)(H3640)(H3739)t2426m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(23dihydro14benzodioxin6yl)Lmethioninamide
ZINC000150653241
ZINC150653241

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Available files

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