Vitas-M small molecule compound
1-ethyl-17-(2-methoxyphenyl)-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
STK263888
SMILES COc1ccccc1N1C(=O)C2C(C1=O)C1(CC)c3c(C2c2c1cccc2)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/c1-3-27-18-12-6-4-10-16(18)22(17-11-5-7-13-19(17)27)23-24(27)26(30)28(25(23)29)20-14-8-9-15-21(20)31-2/h4-15,22-24H,3H2,1-2H3InChIKey
HSUROSTUASOEOM-UHFFFAOYSA-NSynonyms
1ethyl17(2methoxyphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CCC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC=CC=C6OC
InChI=1SC27H23NO3c13271812641016(18)22(1711571319(17)27)2324(27)26(30)28(25(23)29)2014891521(20)312h4152224H3H212H3
MFCD00577864
ZINC000001092522
ZINC000001092525
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