Vitas-M small molecule compound

ethyl [2-chloro-6-methoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenoxy]acetate

Catalog ID
STL172176
SMILES CCOC(=O)COc1c(Cl)cc(cc1OC)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)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 C28H26ClNO5 MW 491.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClNO5/c1-3-34-24(32)15-35-28-20(29)13-17(14-23(28)33-2)27-26-19(9-6-10-22(26)31)25-18-8-5-4-7-16(18)11-12-21(25)30-27/h4-5,7-8,11-14,27,30H,3,6,9-10,15H2,1-2H3
InChIKey
KEHULZQFOPIPOO-UHFFFAOYSA-N
Synonyms

CCOC(=O)COC1=C(C=C(C=C1Cl)C2C3=C(CCCC3=O)C4=C(N2)C=CC5=CC=CC=C54)OC
ethyl(2chloro6methoxy4(4oxo123456hexahydrobenzo(a)phenanthridin5yl)phenoxy)acetate
ethyl2(2chloro6methoxy4(4oxo2356tetrahydro1Hbenzo(a)phenanthridin5yl)phenoxy)acetate
InChI=1SC28H26ClNO5c133424(32)15352820(29)1317(1423(28)332)272619(961022(26)31)2518854716(18)111221(25)3027h457811142730H3691015H212H3
MFCD03722780
ZINC000001135467
ZINC000001135468

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Available files

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