Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-{[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}-L-isoleucinamide
Catalog ID
STL546101
SMILES CC[C@H]([C@@H](C(=O)NCc1onc(n1)c1ccco1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C34H39N5O8 MW 645.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N5O8/c1-7-18(2)30(34(42)35-17-28-38-33(39-47-28)26-9-8-14-46-26)37-24-13-11-21-22(16-25(24)41)23(36-19(3)40)12-10-20-15-27(43-4)31(44-5)32(45-6)29(20)21/h8-9,11,13-16,18,23,30H,7,10,12,17H2,1-6H3,(H,35,42)(H,36,40)(H,37,41)/t18-,23+,30+/m1/InChIKey
MWTHLTVJMZECLE-WEMPGLRGSA-NSynonyms
(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((3(furan2yl)124oxadiazol5yl)methyl)3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((3(furan2yl)124oxadiazol5yl)methyl)3methylpentanamide
121541788
CC(C@H)((C@@H)(C(=O)NCc1onc(n1)c1ccco1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC34H39N5O8c1718(2)30(34(42)3517283833(394728)2698144626)372413112122(1625(24)41)23(3619(3)40)1210201527(434)31(445)32(456)29(20)21h89111316182330H7101217H216H3(H3542)(H3640)(H3741)t1823+30+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N((3(furan2yl)124oxadiazol5yl)methyl)Lisoleucinamide
ZINC000263585812
ZINC263585812
Check stock
See real-time availability and sample size for STL546101 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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