Vitas-M small molecule compound

2-(6-iodopentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaen-4-yl)-1H-isoindole-1,3(2H)-dione (non-preferred name)

Catalog ID
STL351332
SMILES Ic1cc(cc2c1C1c3c(C2c2c1cccc2)cccc3)N1C(=O)c2c(C1=O)cccc2

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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 C28H16INO2 MW 525.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H16INO2/c29-23-14-15(30-27(31)20-11-5-6-12-21(20)28(30)32)13-22-24-16-7-1-3-9-18(16)25(26(22)23)19-10-4-2-8-17(19)24/h1-14,24-25H
InChIKey
VUDLOVKNBCCKOJ-UHFFFAOYSA-N
Synonyms
57690-52-5
2((9s10s)4iodo910dihydro910(12)benzenoanthracen2yl)isoindoline13dione
2(6iodopentacyclo(6660~27~0~914~0~1520~)icosa24691113151719nonaen4yl)1Hisoindole13(2H)dione(nonpreferredname)
57690525
C1=CC=C2C3C4=CC=CC=C4C(C2=C1)C5=CC(=CC(=C35)I)N6C(=O)C7=CC=CC=C7C6=O
InChI=1SC28H16INO2c29231415(3027(31)2011561221(20)28(30)32)13222416713918(16)25(26(22)23)191042817(19)24h1142425H
MFCD00329473
ZINC000101530686
ZINC101530686

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Available files

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