Vitas-M small molecule compound
8-{[bis(2-methylpropyl)ammonio]methyl}-3-(2-bromophenoxy)-2-methyl-4-oxo-4H-chromen-7-olate
Catalog ID
STK590588
SMILES CC(C[NH+](Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccccc1Br)CC(C)C)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 C25H30BrNO4 MW 488.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30BrNO4/c1-15(2)12-27(13-16(3)4)14-19-21(28)11-10-18-23(29)24(17(5)30-25(18)19)31-22-9-7-6-8-20(22)26/h6-11,15-16,28H,12-14H2,1-5H3InChIKey
RZRPPUQMJWUDSD-UHFFFAOYSA-NSynonyms
844650-08-48((BIS(2METHYLPROPYL)AMINO)METHYL)3(2BROMOPHENOXY)7HYDROXY2METHYLCHROMEN4ONE
8((bis(2methylpropyl)ammonio)methyl)3(2bromophenoxy)2methyl4oxo4Hchromen7olate
8((bis(2methylpropyl)azaniumyl)methyl)3(2bromophenoxy)2methyl4oxochromen7olate
CC(C(NH+)(Cc1c((O))ccc2c1oc(C)c(c2=O)Oc1ccccc1Br)CC(C)C)C
CC1=C(C(=O)C2=C(O1)C(=C(C=C2)(O))C(NH+)(CC(C)C)CC(C)C)OC3=CC=CC=C3Br
InChI=1SC25H30BrNO4c115(2)1227(1316(3)4)141921(28)11101823(29)24(17(5)3025(18)19)3122976820(22)26h611151628H1214H215H3
MFCD04158417
ZINC000009215624
ZINC9215624
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