Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-2-[1-({[1-(2-methoxyethyl)-1H-benzimidazol-2-yl]methyl}amino)ethylidene]-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL545822
SMILES COCCn1c(CN/C(=C/2\C(=O)C=C3[C@@](C2=O)(C)c2c(O)c(C)c(c(c2O3)C(=O)C)O)/C)nc2c1cccc2
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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 C29H29N3O7 MW 531.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O7/c1-14-25(35)23(16(3)33)27-24(26(14)36)29(4)20(39-27)12-19(34)22(28(29)37)15(2)30-13-21-31-17-8-6-7-9-18(17)32(21)10-11-38-5/h6-9,12,30,35-36H,10-11,13H2,1-5H3/b22-15+/t29-/m0/s1InChIKey
WSYSOUPDRHJTCF-NKVKBKOUSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1((1(2methoxyethyl)benzimidazol2yl)methylamino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1(((1(2methoxyethyl)1Hbenzimidazol2yl)methyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy2(1(((1(2methoxyethyl)1Hbenzo(d)imidazol2yl)methyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
110207384
COCCn1c(CNC(=C2C(=O)C=C3(C@@)(C2=O)(C)c2c(O)c(C)c(c(c2O3)C(=O)C)O)C)nc2c1cccc2
InChI=1SC29H29N3O7c11425(35)23(16(3)33)2724(26(14)36)29(4)20(3927)1219(34)22(28(29)37)15(2)3013213117867918(17)32(21)1011385h6912303536H101113H215H3b2215+t29m0s1
ZINC000253414197
ZINC253414197
Check stock
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