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-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]propyl}-L-isoleucinamide
Catalog ID
STL550710
SMILES CC[C@H]([C@@H](C(=O)NCCCc1onc(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 C36H43N5O8 MW 673.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H43N5O8/c1-7-20(2)32(36(44)37-16-8-11-30-40-35(41-49-30)28-10-9-17-48-28)39-26-15-13-23-24(19-27(26)43)25(38-21(3)42)14-12-22-18-29(45-4)33(46-5)34(47-6)31(22)23/h9-10,13,15,17-20,25,32H,7-8,11-12,14,16H2,1-6H3,(H,37,44)(H,38,42)(H,39,43)/t20-InChIKey
VODLLOCLAAHTRJ-DBAPWXNWSA-NSynonyms
(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3(3(furan2yl)124oxadiazol5yl)propyl)3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(3(furan2yl)124oxadiazol5yl)propyl)3methylpentanamide
127254027
CC(C@H)((C@@H)(C(=O)NCCCc1onc(n1)c1ccco1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC36H43N5O8c1720(2)32(36(44)3716811304035(414930)28109174828)392615132324(1927(26)43)25(3821(3)42)1412221829(454)33(465)34(476)31(22)23h910131517202532H7811121416H216H3(H3744)(H3842)(H3943)t2025+32+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(3(3(furan2yl)124oxadiazol5yl)propyl)Lisoleucinamide
ZINC000604406390
ZINC604406390
Check stock
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