Vitas-M small molecule compound
1-{9-hydroxy-10-[4-(octyloxy)phenyl]-2-(propan-2-yl)-2,10-dihydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-8(7H)-yl}ethanone
Catalog ID
STL547207
SMILES CCCCCCCCOc1ccc(cc1)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)C(C)C)C(=O)C
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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 C32H39N3O3 MW 513.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39N3O3/c1-5-6-7-8-9-10-18-38-24-16-14-23(15-17-24)29-25-19-34(21(2)3)28-13-11-12-26(30(25)28)33-27-20-35(22(4)36)32(37)31(27)29/h11-17,19,21,29,37H,5-10,18,20H2,1-4H3InChIKey
HRYLKQWUHMORJF-UHFFFAOYSA-NSynonyms
1(9hydroxy10(4(octyloxy)phenyl)2(propan2yl)210dihydropyrrolo(3467)azepino(432cd)indol8(7H)yl)ethanone
InChI=1SC32H39N3O3c15678910183824161423(151724)29251934(21(2)3)2813111226(30(25)28)33272035(22(4)36)32(37)31(27)29h111719212937H5101820H214H3
MFCD31756525
ZINC000409413763
ZINC000409413764
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