Vitas-M small molecule compound
16-(4-bromophenyl)-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Catalog ID
STK571229
SMILES Brc1ccc(cc1)C1C=C2N(C3=C1C(=O)CCC3)CCc1c2cc2OCCCOc2c1
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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 C26H24BrNO3 MW 478.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrNO3/c27-18-7-5-16(6-8-18)20-14-22-19-15-25-24(30-11-2-12-31-25)13-17(19)9-10-28(22)21-3-1-4-23(29)26(20)21/h5-8,13-15,20H,1-4,9-12H2InChIKey
OZHCGPNGHZTQHX-UHFFFAOYSA-NSynonyms
904209-84-316(4bromophenyl)23467111216octahydro1H10H(14)dioxepino(2367)isoquino(21a)quinolin1one
16(4bromophenyl)346710111216octahydro(14)dioxepino(2367)isoquinolino(21a)quinolin1(2H)one
904209843
C1CC2=C(C(C=C3N2CCC4=CC5=C(C=C43)OCCCO5)C6=CC=C(C=C6)Br)C(=O)C1
InChI=1SC26H24BrNO3c27187516(6818)20142219152524(30112123125)1317(19)91028(22)2131423(29)26(20)21h58131520H14912H2
MFCD07639661
ZINC000009129103
ZINC000009129105
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