Vitas-M small molecule compound
13-[5-(4-acetylphenyl)furan-2-yl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Catalog ID
STK579129
SMILES COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3ccc(o3)c3ccc(cc3)C(=O)C)c2cc1OC
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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 C33H33NO5 MW 523.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO5/c1-19(35)20-6-8-21(9-7-20)28-10-11-29(39-28)24-15-25-23-16-31(38-5)30(37-4)14-22(23)12-13-34(25)26-17-33(2,3)18-27(36)32(24)26/h6-11,14-16,24H,12-13,17-18H2,1-5H3InChIKey
DTWYOYDTOIFULE-UHFFFAOYSA-NSynonyms
898925-50-313(5(4acetylphenyl)furan2yl)910dimethoxy33dimethyl2346713hexahydro1Hisoquino(21a)quinolin1one
13(5(4acetylphenyl)furan2yl)910dimethoxy33dimethyl2346713hexahydro1Hisoquinolino(21a)quinolin1one
13(5(4acetylphenyl)furan2yl)910dimethoxy33dimethyl46713tetrahydro2Hisoquinolino(21a)quinolin1one
898925503
CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3C=C4C5=CC(=C(C=C5CCN4C6=C3C(=O)CC(C6)(C)C)OC)OC
InChI=1SC33H33NO5c119(35)206821(9720)28101129(3928)241525231631(385)30(374)1422(23)121334(25)261733(23)1827(36)32(24)26h611141624H12131718H215H3
MFCD07640176
ZINC000009129430
ZINC000009129432
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