Vitas-M small molecule compound
N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-leucyl-L-valine
Catalog ID
STL546099
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)NC(=O)C)cc(c1OC)OC
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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 C32H43N3O8 MW 597.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H43N3O8/c1-16(2)13-24(31(38)35-28(17(3)4)32(39)40)34-23-12-10-20-21(15-25(23)37)22(33-18(5)36)11-9-19-14-26(41-6)29(42-7)30(43-8)27(19)20/h10,12,14-17,22,24,28H,9,11,13H2,1-8H3,(H,33,36)(H,34,37)(H,35,38)(H,39,40)/t22-,24-,28-/m0/s1InChIKey
UPKPCFNNDPDURE-HPJWIMSGSA-NSynonyms
(2~(S))2(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylpentanoyl)amino)3methylbutanoicacid
(S)2((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4methylpentanamido)3methylbutanoicacid
121542027
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)N(C@H)(C(=O)O)C(C)C)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC32H43N3O8c116(2)1324(31(38)3528(17(3)4)32(39)40)342312102021(1525(23)37)22(3318(5)36)119191426(416)29(427)30(438)27(19)20h10121417222428H91113H218H3(H3336)(H3437)(H3538)(H3940)t222428m0s1
N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)LleucylLvaline
ZINC000263586456
ZINC263586456
Check stock
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Check stock on Vitas-MAvailable files
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