Vitas-M small molecule compound
5-(4-butoxyphenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK843414
SMILES CCCCOc1ccc(cc1)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 C29H31NO2 MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31NO2/c1-4-5-16-32-21-13-10-20(11-14-21)28-27-23(17-29(2,3)18-25(27)31)26-22-9-7-6-8-19(22)12-15-24(26)30-28/h6-15,28,30H,4-5,16-18H2,1-3H3InChIKey
DIROGGFVUDXQJR-UHFFFAOYSA-NSynonyms
332129-57-4332129574
5(4butoxyphenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(4butoxyphenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54
InChI=1SC29H31NO2c145163221131020(111421)282723(1729(23)1825(27)31)2622976819(22)121524(26)3028h6152830H451618H213H3
MFCD00715061
ZINC000002063478
ZINC000002063479
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