Vitas-M small molecule compound
2-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-6-methoxyphenyl acetate
Catalog ID
STK762328
SMILES COc1cc(cc(c1OC(=O)C)Br)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)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 C28H26BrNO4 MW 520.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26BrNO4/c1-15(31)34-27-20(29)11-17(12-23(27)33-4)26-25-19(13-28(2,3)14-22(25)32)24-18-8-6-5-7-16(18)9-10-21(24)30-26/h5-12,26,30H,13-14H2,1-4H3InChIKey
FUDUBOIVGOQZJK-UHFFFAOYSA-NSynonyms
(2bromo4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)6methoxyphenyl)acetate
2bromo4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)6methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1Br)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)OC
InChI=1SC28H26BrNO4c115(31)342720(29)1117(1223(27)334)262519(1328(23)1422(25)32)2418865716(18)91021(24)3026h5122630H1314H214H3
MFCD01785670
ZINC000002186261
ZINC000002186262
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