Vitas-M small molecule compound
5-bromo-4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl acetate
Catalog ID
STK763135
SMILES CCOc1cc(c(cc1OC(=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 C29H28BrNO4 MW 534.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28BrNO4/c1-5-34-24-12-19(21(30)13-25(24)35-16(2)32)28-27-20(14-29(3,4)15-23(27)33)26-18-9-7-6-8-17(18)10-11-22(26)31-28/h6-13,28,31H,5,14-15H2,1-4H3InChIKey
ZUUJCLMNFUDXQQ-UHFFFAOYSA-NSynonyms
(5bromo4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)2ethoxyphenyl)acetate
5bromo4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)2ethoxyphenylacetate
CCOC1=C(C=C(C(=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)Br)OC(=O)C
InChI=1SC29H28BrNO4c1534241219(21(30)1325(24)3516(2)32)282720(1429(34)1523(27)33)2618976817(18)101122(26)3128h6132831H51415H214H3
MFCD01784423
ZINC000002063389
ZINC000002063390
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