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

Catalog ID
STL545477
SMILES CSCC[C@@H](C(=O)NCCn1c(=O)c(O)nc2c1cccc2)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 C36H41N5O8S MW 703.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H41N5O8S/c1-20(42)38-24-12-10-21-18-30(47-2)32(48-3)33(49-4)31(21)22-11-13-26(29(43)19-23(22)24)39-27(14-17-50-5)34(44)37-15-16-41-28-9-7-6-8-25(28)40-35(45)36(41)46/h6-9,11,13,18-19,24,27H,10,12,14-17H2,1-5H3,(H,37,44)(H,38,42)(H,39,43)(H,40,
InChIKey
YSPKLVVMZUKLMR-IGKIAQTJSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(23dioxo4~(H)quinoxalin1yl)ethyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(3hydroxy2oxoquinoxalin1(2H)yl)ethyl)4(methylthio)butanamide
110206378
CSCC(C@@H)(C(=O)NCCn1c(=O)c(O)nc2c1cccc2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC36H41N5O8Sc120(42)38241210211830(472)32(483)33(494)31(21)22111326(29(43)1923(22)24)3927(1417505)34(44)3715164128976825(28)4035(45)36(41)46h69111318192427H10121417H215H3(H3744)(H3842)(H3943)(H4045)t2427m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(3hydroxy2oxoquinoxalin1(2H)yl)ethyl)Lmethioninamide
ZINC000253414827
ZINC253414827

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Available files

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