Vitas-M small molecule compound
5-[4-(benzyloxy)-3-methoxyphenyl]-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK724392
SMILES COc1cc(ccc1OCc1ccccc1)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 C33H31NO3 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31NO3/c1-33(2)18-25-30-24-12-8-7-11-22(24)13-15-26(30)34-32(31(25)27(35)19-33)23-14-16-28(29(17-23)36-3)37-20-21-9-5-4-6-10-21/h4-17,32,34H,18-20H2,1-3H3InChIKey
MLTDCNGICDWACF-UHFFFAOYSA-NSynonyms
5(3methoxy4phenylmethoxyphenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(4(benzyloxy)3methoxyphenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)OCC6=CC=CC=C6)OC)C(=O)C1)C
InChI=1SC33H31NO3c133(2)1825302412871122(24)131526(30)3432(31(25)27(35)1933)23141628(29(1723)363)37202195461021h4173234H1820H213H3
MFCD00809165
ZINC000002187050
ZINC000002187051
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