Vitas-M small molecule compound
17-(1,3-benzodioxol-5-yl)-1-methyl-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
STK727443
SMILES O=C1N(c2ccc3c(c2)OCO3)C(=O)C2C1C1c3ccccc3C2(c2c1cccc2)C
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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 C26H19NO4 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19NO4/c1-26-17-8-4-2-6-15(17)21(16-7-3-5-9-18(16)26)22-23(26)25(29)27(24(22)28)14-10-11-19-20(12-14)31-13-30-19/h2-12,21-23H,13H2,1H3InChIKey
CVEGDIZBQJTGHI-UHFFFAOYSA-NSynonyms
17(13benzodioxol5yl)1methyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC7=C(C=C6)OCO7
InChI=1SC26H19NO4c12617842615(17)21(16735918(16)26)2223(26)25(29)27(24(22)28)1410111920(1214)31133019h2122123H13H21H3
MFCD01460146
ZINC000000707259
ZINC000000707262
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