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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-(1,3-benzodioxol-5-ylmethyl)-L-methioninamide

Catalog ID
STL541340
SMILES CSCC[C@@H](C(=O)NCc1ccc2c(c1)OCO2)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)36-24-9-7-21-15-30(41-2)32(42-3)33(43-4)31(21)22-8-10-25(27(39)16-23(22)24)37-26(12-13-46-5)34(40)35-17-20-6-11-28-29(14-20)45-18-44-28/h6,8,10-11,14-16,24,26H,7,9,12-13,17-18H2,1-5H3,(H,35,40)(H,36,38)(H,37,39)/t24-,26-/m0/s
InChIKey
OWSUBRMOBBGPOM-AHWVRZQESA-N
Synonyms
1574360-48-7
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(13benzodioxol5ylmethyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(benzo(d)(13)dioxol5ylmethyl)4(methylthio)butanamide
1574360487
75491808
CSCC(C@@H)(C(=O)NCc1ccc2c(c1)OCO2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC34H39N3O8Sc119(38)362497211530(412)32(423)33(434)31(21)2281025(27(39)1623(22)24)3726(1213465)34(40)3517206112829(1420)45184428h68101114162426H7912131718H215H3(H3540)(H3638)(H3739)t2426m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(13benzodioxol5ylmethyl)Lmethioninamide
ZINC000150653478
ZINC150653478

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Available files

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