Vitas-M small molecule compound
5-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK758201
SMILES COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)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 C30H26N2O5 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O5/c1-30(2)15-21-27-19-7-5-4-6-17(19)8-11-22(27)31-29(28(21)24(33)16-30)26-13-12-25(37-26)20-10-9-18(36-3)14-23(20)32(34)35/h4-14,29,31H,15-16H2,1-3H3InChIKey
CKOQPMNQLDCSKX-UHFFFAOYSA-NSynonyms
5(5(4methoxy2nitrophenyl)furan2yl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(5(4methoxy2nitrophenyl)furan2yl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(O5)C6=C(C=C(C=C6)OC)(N+)(=O)(O))C(=O)C1)C
COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
InChI=1SC30H26N2O5c130(2)15212719754617(19)81122(27)3129(28(21)24(33)1630)26131225(3726)2010918(363)1423(20)32(34)35h4142931H1516H213H3
MFCD01099588
ZINC000004434027
ZINC000004434034
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