Vitas-M small molecule compound

2-(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)-4-methylpentanoic acid (non-preferred name)

Catalog ID
STL059267
SMILES CC(CC(N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)C(=O)O)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 C24H23NO4 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO4/c1-12(2)11-17(24(28)29)25-22(26)20-18-13-7-3-4-8-14(13)19(21(20)23(25)27)16-10-6-5-9-15(16)18/h3-10,12,17-21H,11H2,1-2H3,(H,28,29)
InChIKey
PGJVHPHCIWSPOX-UHFFFAOYSA-N
Synonyms
306967-37-3
2((11S15R)1214dioxo11121415tetrahydro9H910(34)epipyrroloanthracen13(10H)yl)4methylpentanoicacid
2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)4methylpentanoicacid(nonpreferredname)
306967373
CC(C)CC(C(=O)O)N1C(=O)C2C(C1=O)C3C4=CC=CC=C4C2C5=CC=CC=C35
CC(CC(N1C(=O)C2(C@@H)(C1=O)C1c3c((C@H)2c2c1cccc2)cccc3)C(=O)O)C
InChI=1SC24H23NO4c112(2)1117(24(28)29)2522(26)201813734814(13)19(21(20)23(25)27)161065915(16)18h310121721H11H212H3(H2829)
MFCD02170923
ZINC000002818049
ZINC000015837769

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Available files

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