Vitas-M small molecule compound
2-ethoxy-4-(11-oxo-9-phenyl-7,8,9,10,11,12-hexahydrobenzo[a]acridin-12-yl)phenyl 3-methylbutanoate
Catalog ID
STK687031
SMILES CCOc1cc(ccc1OC(=O)CC(C)C)C1C2=C(CC(CC2=O)c2ccccc2)Nc2c1c1ccccc1cc2
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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 C36H35NO4 MW 545.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H35NO4/c1-4-40-32-21-25(15-17-31(32)41-33(39)18-22(2)3)34-35-27-13-9-8-12-24(27)14-16-28(35)37-29-19-26(20-30(38)36(29)34)23-10-6-5-7-11-23/h5-17,21-22,26,34,37H,4,18-20H2,1-3H3InChIKey
KYEYPAFYHRWCOU-UHFFFAOYSA-NSynonyms
(2ethoxy4(11oxo9phenyl891012tetrahydro7Hbenzo(a)acridin12yl)phenyl)3methylbutanoate
2ethoxy4(11oxo9phenyl789101112hexahydrobenzo(a)acridin12yl)phenyl3methylbutanoate
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=C2C6=CC=CC=C6C=C5)OC(=O)CC(C)C
InChI=1SC36H35NO4c1440322125(151731(32)4133(39)1822(2)3)34352713981224(27)141628(35)37291926(2030(38)36(29)34)23106571123h5172122263437H41820H213H3
MFCD07656999
ZINC000100204287
ZINC000100204301
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