Vitas-M small molecule compound
17-(4-acetylphenyl)-1-(dimethoxymethyl)-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
STK757883
SMILES COC(C12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)c1ccc(cc1)C(=O)C)OC
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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 C29H25NO5 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO5/c1-16(31)17-12-14-18(15-13-17)30-26(32)24-23-19-8-4-6-10-21(19)29(25(24)27(30)33,28(34-2)35-3)22-11-7-5-9-20(22)23/h4-15,23-25,28H,1-3H3InChIKey
SOEBERCJCTWLMN-UHFFFAOYSA-NSynonyms
17(4acetylphenyl)1(dimethoxymethyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC(=O)C1=CC=C(C=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C(OC)OC
InChI=1SC29H25NO5c116(31)17121418(151317)3026(32)2423198461021(19)29(25(24)27(30)3328(342)353)221175920(22)23h415232528H13H3
MFCD01031780
ZINC000000713915
ZINC000000713921
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