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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-(6-chloro-3-hydroxy-2-oxoquinoxalin-1(2H)-yl)ethyl]-L-methioninamide

Catalog ID
STL546463
SMILES CSCC[C@@H](C(=O)NCCn1c(=O)c(O)nc2c1ccc(c2)Cl)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 C36H40ClN5O8S MW 738.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H40ClN5O8S/c1-19(43)39-24-9-6-20-16-30(48-2)32(49-3)33(50-4)31(20)22-8-10-25(29(44)18-23(22)24)40-26(12-15-51-5)34(45)38-13-14-42-28-11-7-21(37)17-27(28)41-35(46)36(42)47/h7-8,10-11,16-18,24,26H,6,9,12-15H2,1-5H3,(H,38,45)(H,39,43)(H,40,44)(H,
InChIKey
SIXANZOGQLWLQQ-AHWVRZQESA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(6chloro23dioxo4~(H)quinoxalin1yl)ethyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(6chloro3hydroxy2oxoquinoxalin1(2H)yl)ethyl)4(methylthio)butanamide
121541741
CSCC(C@@H)(C(=O)NCCn1c(=O)c(O)nc2c1ccc(c2)Cl)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H40ClN5O8Sc119(43)392496201630(482)32(493)33(504)31(20)2281025(29(44)1823(22)24)4026(1215515)34(45)381314422811721(37)1727(28)4135(46)36(42)47h78101116182426H691215H215H3(H3845)(H3943)(H4044)(H4146)t2426m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(6chloro3hydroxy2oxoquinoxalin1(2H)yl)ethyl)Lmethioninamide
ZINC000263586291
ZINC263586291

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Available files

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