Vitas-M small molecule compound

(2E,9bR)-6-acetyl-2-(1-{[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione

Catalog ID
STL547884
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCc1c(C)n[nH]c1C

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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 C24H25N3O6 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O6/c1-9-20(30)18(13(5)28)22-19(21(9)31)24(6)16(33-22)7-15(29)17(23(24)32)12(4)25-8-14-10(2)26-27-11(14)3/h7,25,30-31H,8H2,1-6H3,(H,26,27)/b17-12+/t24-/m0/s1
InChIKey
WUDVWBJQILZGKX-JYFCICGUSA-N
Synonyms

(2~(E)9~(b)~(R))6acetyl2(1((35dimethyl1~(H)pyrazol4yl)methylamino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1(((35dimethyl1Hpyrazol4yl)methyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl2(1(((35dimethyl1Hpyrazol4yl)methyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110207943
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCc1c(C)n(nH)c1C
InChI=1SC24H25N3O6c1920(30)18(13(5)28)2219(21(9)31)24(6)16(3322)715(29)17(23(24)32)12(4)2581410(2)262711(14)3h7253031H8H216H3(H2627)b1712+t24m0s1
ZINC000253414209
ZINC253414209

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Available files

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