Vitas-M small molecule compound
14-[4-(dimethylamino)phenyl]-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Catalog ID
STK579526
SMILES O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1OCOc1c2)c1ccc(cc1)N(C)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 C28H30N2O3 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O3/c1-28(2)14-23-27(24(31)15-28)21(17-5-7-19(8-6-17)29(3)4)12-22-20-13-26-25(32-16-33-26)11-18(20)9-10-30(22)23/h5-8,11-13,21H,9-10,14-16H2,1-4H3InChIKey
QXJIZEDAZFEIDY-UHFFFAOYSA-NSynonyms
14(4(dimethylamino)phenyl)33dimethyl2346714hexahydro1H(13)dioxolo(4567)isoquinolino(21a)quinolin1one
14(4(dimethylamino)phenyl)33dimethyl2346714hexahydro1H(13)dioxolo(67)isoquino(21a)quinolin1one
CC1(CC2=C(C(C=C3N2CCC4=CC5=C(C=C43)OCO5)C6=CC=C(C=C6)N(C)C)C(=O)C1)C
InChI=1SC28H30N2O3c128(2)142327(24(31)1528)21(175719(8617)29(3)4)122220132625(32163326)1118(20)91030(22)23h58111321H9101416H214H3
MFCD07640109
ZINC000009129366
ZINC000009129367
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