Vitas-M small molecule compound
2-(1,8-dibromo-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)phenyl furan-2-carboxylate (non-preferred name)
Catalog ID
STK286453
SMILES O=C(c1ccco1)Oc1ccccc1N1C(=O)C2C(C1=O)C1(Br)c3c(C2(Br)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 C29H17Br2NO5 MW 619.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H17Br2NO5/c30-28-16-8-1-2-9-17(16)29(31,19-11-4-3-10-18(19)28)24-23(28)25(33)32(26(24)34)20-12-5-6-13-21(20)37-27(35)22-14-7-15-36-22/h1-15,23-24HInChIKey
SLHDSYYRSHVKNF-UHFFFAOYSA-NSynonyms
2(18dibromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenylfuran2carboxylate(nonpreferredname)
C1=CC=C2C(=C1)C3(C4C(C2(C5=CC=CC=C53)Br)C(=O)N(C4=O)C6=CC=CC=C6OC(=O)C7=CC=CO7)Br
InChI=1SC29H17Br2NO5c302816812917(16)29(311911431018(19)28)2423(28)25(33)32(26(24)34)2012561321(20)3727(35)22147153622h1152324H
MFCD03273976
ZINC000097948939
ZINC000097948941
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