Vitas-M small molecule compound
methyl 4-(3,3-dimethyl-1-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)benzoate
Catalog ID
STK753951
SMILES COC(=O)c1ccc(cc1)C1Nc2ccc3c(c2C2=C1CC(C)(C)CC2=O)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 C27H25NO3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO3/c1-27(2)14-20-24(22(29)15-27)23-19-7-5-4-6-16(19)12-13-21(23)28-25(20)17-8-10-18(11-9-17)26(30)31-3/h4-13,25,28H,14-15H2,1-3H3InChIKey
PFSVYNIOXMODFF-UHFFFAOYSA-NSynonyms
CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CC=C(C=C5)C(=O)OC)C
InChI=1SC27H25NO3c127(2)142024(22(29)1527)2319754616(19)121321(23)2825(20)1781018(11917)26(30)313h4132528H1415H213H3
methyl4(33dimethyl1oxo123456hexahydrobenzo(a)phenanthridin5yl)benzoate
methyl4(33dimethyl1oxo2456tetrahydrobenzo(a)phenanthridin5yl)benzoate
MFCD00501787
ZINC000000712743
ZINC000000712744
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