Vitas-M small molecule compound

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

Catalog ID
STL548303
SMILES Cn1ncc(c1)CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/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 C23H23N3O6 MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O6/c1-10-19(29)17(12(3)27)21-18(20(10)30)23(4)15(32-21)6-14(28)16(22(23)31)11(2)24-7-13-8-25-26(5)9-13/h6,8-9,24,29-30H,7H2,1-5H3/b16-11+/t23-/m0/s1
InChIKey
AMLWFCFREPJGOD-LJJIPZOBSA-N
Synonyms

(2~(E)9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl2(1((1methylpyrazol4yl)methylamino)ethylidene)dibenzofuran13dione
(2E9bR)6acetyl79dihydroxy89bdimethyl2(1(((1methyl1Hpyrazol4yl)methyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy89bdimethyl2(1(((1methyl1Hpyrazol4yl)methyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
110208101
Cn1ncc(c1)CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
InChI=1SC23H23N3O6c11019(29)17(12(3)27)2118(20(10)30)23(4)15(3221)614(28)16(22(23)31)11(2)2471382526(5)913h689242930H7H215H3b1611+t23m0s1
ZINC000253395599
ZINC253395599

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Available files

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