Vitas-M small molecule compound
17-(3-methoxyphenyl)-1,8-dimethyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK258036
SMILES COc1cccc(c1)N1C(=O)C2C(C1=O)C1(C)c3c(C2(C)c2c1cccc2)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 C27H23NO3 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO3/c1-26-18-11-4-6-13-20(18)27(2,21-14-7-5-12-19(21)26)23-22(26)24(29)28(25(23)30)16-9-8-10-17(15-16)31-3/h4-15,22-23H,1-3H3InChIKey
WBTJQEYOWCNSFS-UHFFFAOYSA-NSynonyms
17(3methoxyphenyl)18dimethyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(=O)N(C3=O)C4=CC(=CC=C4)OC)C(C5=CC=CC=C51)(C6=CC=CC=C26)C
InChI=1SC27H23NO3c1261811461320(18)27(22114751219(21)26)2322(26)24(29)28(25(23)30)16981017(1516)313h4152223H13H3
MFCD02294353
ZINC000001205359
ZINC000018082332
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