Vitas-M small molecule compound
methyl 9,9-dimethyl-12-(4-methylphenyl)-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthroline-10-carboxylate
Catalog ID
STK688985
SMILES COC(=O)C1C(=O)C2=C(CC1(C)C)Nc1c(C2c2ccc(cc2)C)c2cccnc2cc1
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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 C27H26N2O3 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3/c1-15-7-9-16(10-8-15)21-22-17-6-5-13-28-18(17)11-12-19(22)29-20-14-27(2,3)24(26(31)32-4)25(30)23(20)21/h5-13,21,24,29H,14H2,1-4H3InChIKey
OZDRJIWWJNRYEC-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C3=C(CC(C(C3=O)C(=O)OC)(C)C)NC4=C2C5=C(C=C4)N=CC=C5
InChI=1SC27H26N2O3c1157916(10815)21221765132818(17)111219(22)29201427(23)24(26(31)324)25(30)23(20)21h513212429H14H214H3
methyl99dimethyl12(4methylphenyl)11oxo781012tetrahydrobenzo(b)(47)phenanthroline10carboxylate
methyl99dimethyl12(4methylphenyl)11oxo789101112hexahydrobenzo(b)(47)phenanthroline10carboxylate
MFCD07800108
ZINC000015024024
ZINC000015024034
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