Vitas-M small molecule compound
5,7-dihydroxy-8-[1-(7-methoxy-1,3-benzodioxol-5-yl)-3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-phenyl-4H-chromen-4-one
Catalog ID
STL540912
SMILES COc1cc(cc2c1OCO2)C(c1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O)CC(=O)N1CCN(CC1)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 C31H30N2O8 MW 558.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O8/c1-32-8-10-33(11-9-32)27(37)14-20(19-12-25(38-2)30-26(13-19)39-17-40-30)28-21(34)15-22(35)29-23(36)16-24(41-31(28)29)18-6-4-3-5-7-18/h3-7,12-13,15-16,20,34-35H,8-11,14,17H2,1-2H3InChIKey
KSFLTEQSOXQOMK-UHFFFAOYSA-NSynonyms
1574317-85-31574317853
57dihydroxy8(1(7methoxy13benzodioxol5yl)3(4methylpiperazin1yl)3oxopropyl)2phenyl4Hchromen4one
57dihydroxy8(1(7methoxy13benzodioxol5yl)3(4methylpiperazin1yl)3oxopropyl)2phenylchromen4one
57DIHYDROXY8(1(7METHOXYBENZO(D)(13)DIOXOL5YL)3(4METHYLPIPERAZIN1YL)3OXOPROPYL)2PHENYL4HCHROMEN4ONE
71827161
InChI=1SC31H30N2O8c13281033(11932)27(37)1420(191225(382)3026(1319)39174030)2821(34)1522(35)2923(36)1624(4131(28)29)186435718h3712131516203435H8111417H212H3
MFCD28050772
ZINC000097971880
ZINC000097971881
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