Vitas-M small molecule compound
8-[1-(1,3-benzodioxol-5-yl)-3-(4-methylpiperazin-1-yl)-3-oxopropyl]-5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one
Catalog ID
STL540032
SMILES CN1CCN(CC1)C(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc2c(c1)OCO2
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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 C30H28N2O8 MW 544.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O8/c1-31-9-11-32(12-10-31)24(34)14-19(18-7-8-21-23(13-18)39-16-38-21)25-27(35)29(37)28(36)26-20(33)15-22(40-30(25)26)17-5-3-2-4-6-17/h2-8,13,15,19,35-37H,9-12,14,16H2,1H3InChIKey
GWSIMFXBBVKYKT-UHFFFAOYSA-NSynonyms
1630869-49-61630869496
8(1(13benzodioxol5yl)3(4methylpiperazin1yl)3oxopropyl)567trihydroxy2phenyl4Hchromen4one
8(1(13benzodioxol5yl)3(4methylpiperazin1yl)3oxopropyl)567trihydroxy2phenylchromen4one
8(1(BENZO(D)(13)DIOXOL5YL)3(4METHYLPIPERAZIN1YL)3OXOPROPYL)567TRIHYDROXY2PHENYL4HCHROMEN4ONE
91637974
InChI=1SC30H28N2O8c13191132(121031)24(34)1419(18782123(1318)39163821)2527(35)29(37)28(36)2620(33)1522(4030(25)26)175324617h281315193537H9121416H21H3
MFCD28349714
ZINC000217828352
ZINC000217828434
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