Vitas-M small molecule compound
6-[(9,10,12,13-tetramethoxy-3-methyl-4,5-dihydro-3H-phenanthro[1,2-d]azepin-2-yl)carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Catalog ID
STL522957
SMILES COc1c2C=C(N(CCc2c2c(c1OC)c1cc(OC)c(cc1cc2)OC)C)C(=O)c1ccc2c(c1)NC(=O)CO2
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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 C32H30N2O7 MW 554.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O7/c1-34-11-10-19-20-8-6-17-13-26(37-2)27(38-3)15-21(17)29(20)32(40-5)31(39-4)22(19)14-24(34)30(36)18-7-9-25-23(12-18)33-28(35)16-41-25/h6-9,12-15H,10-11,16H2,1-5H3,(H,33,35)InChIKey
IBBRUIMDQANPLH-UHFFFAOYSA-NSynonyms
121541930
6((9101213tetramethoxy3methyl45dihydro3Hphenanthro(12d)azepin2yl)carbonyl)2H14benzoxazin3(4H)one
6(9101213tetramethoxy3methyl45dihydro3Hphenanthro(12d)azepine2carbonyl)2Hbenzo(b)(14)oxazin3(4H)one
6(9101415tetramethoxy5methyl5azatetracyclo(9800^(28)0^(1217))nonadeca1681012141618octaene6carbonyl)4~(H)14benzoxazin3one
InChI=1SC32H30N2O7c1341110192086171326(372)27(383)1521(17)29(20)32(405)31(394)22(19)1424(34)30(36)18792523(1218)3328(35)164125h691215H101116H215H3(H3335)
MFCD30344448
ZINC000263585388
ZINC263585388
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