Vitas-M small molecule compound
methyl 3-(1-formyl-8-methyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name)
Catalog ID
STK760140
SMILES COC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1(C=O)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 C28H21NO5 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO5/c1-27-18-10-3-5-12-20(18)28(15-30,21-13-6-4-11-19(21)27)23-22(27)24(31)29(25(23)32)17-9-7-8-16(14-17)26(33)34-2/h3-15,22-23H,1-2H3InChIKey
DLWHSWMQKUVFPL-UHFFFAOYSA-NSynonyms
CC12C3C(C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)OC)C(C5=CC=CC=C51)(C6=CC=CC=C26)C=O
InChI=1SC28H21NO5c1271810351220(18)28(15302113641119(21)27)2322(27)24(31)29(25(23)32)1797816(1417)26(33)342h3152223H12H3
methyl3(1formyl8methyl1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
MFCD01571998
ZINC000000708062
ZINC000000708065
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Check stock on Vitas-MAvailable files
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