Vitas-M small molecule compound
cyclohexyl (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)acetate (non-preferred name)
Catalog ID
STK268575
SMILES O=C(CN1C(=O)C2C(C1=O)C1(Br)c3c(C2(Br)c2c1cccc2)cccc3)OC1CCCCC1
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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 C26H23Br2NO4 MW 573.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Br2NO4/c27-25-16-10-4-5-11-17(16)26(28,19-13-7-6-12-18(19)25)22-21(25)23(31)29(24(22)32)14-20(30)33-15-8-2-1-3-9-15/h4-7,10-13,15,21-22H,1-3,8-9,14H2InChIKey
QHKHMXKOHCFIMB-UHFFFAOYSA-NSynonyms
C1CCC(CC1)OC(=O)CN2C(=O)C3C(C2=O)C4(C5=CC=CC=C5C3(C6=CC=CC=C64)Br)Br
cyclohexyl(18dibromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)acetate(nonpreferredname)
InChI=1SC26H23Br2NO4c27251610451117(16)26(281913761218(19)25)2221(25)23(31)29(24(22)32)1420(30)33158213915h471013152122H138914H2
MFCD01174538
ZINC000003216096
ZINC000003216099
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