Vitas-M small molecule compound
(3aS,6R)-N,2-bis[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL553320
SMILES O=C(C1C2C=CC3(C1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NCCc1c[nH]c2c1cccc2
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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 C29H28N4O3 MW 480.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3/c34-27(30-13-10-18-15-31-22-7-3-1-5-20(18)22)25-24-9-12-29(36-24)17-33(28(35)26(25)29)14-11-19-16-32-23-8-4-2-6-21(19)23/h1-9,12,15-16,24-26,31-32H,10-11,13-14,17H2,(H,30,34)InChIKey
KEJXYMQLJYZAFQ-UHFFFAOYSA-NSynonyms
1212287-48-3(3aS6R)N2bis(2(1Hindol3yl)ethyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxamide
~(N)3bis(2(1~(H)indol3yl)ethyl)4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxamide
1212287483
73257130
InChI=1SC29H28N4O3c3427(30131018153122731520(18)22)252491229(3624)1733(28(35)26(25)29)141119163223842621(19)23h1912151624263132H1011131417H2(H3034)
O=C((C@H)1(C@@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CCc1c(nH)c3c1cccc3)O2)NCCc1c(nH)c2c1cccc2
ZINC000252694408
ZINC000252694411
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