Vitas-M small molecule compound
17-[2-(3,4-dimethoxyphenyl)ethyl]-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
STK758572
SMILES COc1cc(CCN2C(=O)C3C(C2=O)C2(C)c4c(C3c3c2cccc3)cccc4)ccc1OC
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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 C29H27NO4 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO4/c1-29-20-10-6-4-8-18(20)24(19-9-5-7-11-21(19)29)25-26(29)28(32)30(27(25)31)15-14-17-12-13-22(33-2)23(16-17)34-3/h4-13,16,24-26H,14-15H2,1-3H3InChIKey
GIPFRWHEHPBODT-UHFFFAOYSA-NSynonyms
309939-06-8(9R10R11S15S)13(34dimethoxyphenethyl)9methyl1115dihydro9H910(34)epipyrroloanthracene1214(10H13H)dione
17(2(34dimethoxyphenyl)ethyl)1methyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
309939068
CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)CCC6=CC(=C(C=C6)OC)OC
InChI=1SC29H27NO4c129201064818(20)24(199571121(19)29)2526(29)28(32)30(27(25)31)151417121322(332)23(1617)343h413162426H1415H213H3
MFCD01188343
ZINC000000707123
ZINC000000707126
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