Vitas-M small molecule compound
7-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Catalog ID
STK997697
SMILES COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
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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 C32H23N3O8 MW 577.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23N3O8/c1-16-28(35(38)39)17(2)34(33-16)15-19-14-18(12-13-22(19)40-3)25-26-29(20-8-4-6-10-23(20)41-31(26)36)43-30-21-9-5-7-11-24(21)42-32(37)27(25)30/h4-14,25H,15H2,1-3H3InChIKey
ZCDFBVKVDFGEEB-UHFFFAOYSA-NSynonyms
7(3((35dimethyl4nitro1Hpyrazol1yl)methyl)4methoxyphenyl)6H7H8Hpyrano(32c56c)dichromene68dione
7(3((35dimethyl4nitro1Hpyrazol1yl)methyl)4methoxyphenyl)6Hpyrano(32c56c)dichromene68(7H)dione
CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C4=C(C5=CC=CC=C5OC4=O)OC6=C3C(=O)OC7=CC=CC=C76)OC)C)(N+)(=O)(O)
COc1ccc(cc1Cn1nc(c(c1C)(N+)(=O)(O))C)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
InChI=1SC32H23N3O8c11628(35(38)39)17(2)34(3316)15191418(121322(19)403)252629(208461023(20)4131(26)36)4330219571124(21)4232(37)27(25)30h41425H15H213H3
MFCD02163557
ZINC000103925847
ZINC103925847
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