Vitas-M small molecule compound

13-(4-ethoxy-3-methoxyphenyl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one

Catalog ID
STK596601
SMILES CCOc1ccc(cc1OC)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc(OC)c(c1)OC

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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 C30H35NO5 MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO5/c1-7-36-25-9-8-18(12-26(25)33-4)21-14-22-20-15-28(35-6)27(34-5)13-19(20)10-11-31(22)23-16-30(2,3)17-24(32)29(21)23/h8-9,12-15,21H,7,10-11,16-17H2,1-6H3
InChIKey
RXYCSMQYHVTGNB-UHFFFAOYSA-N
Synonyms

13(4ethoxy3methoxyphenyl)910dimethoxy33dimethyl2346713hexahydro1Hisoquino(21a)quinolin1one
13(4ethoxy3methoxyphenyl)910dimethoxy33dimethyl2346713hexahydro1Hisoquinolino(21a)quinolin1one
13(4ethoxy3methoxyphenyl)910dimethoxy33dimethyl46713tetrahydro2Hisoquinolino(21a)quinolin1one
CCOC1=C(C=C(C=C1)C2C=C3C4=CC(=C(C=C4CCN3C5=C2C(=O)CC(C5)(C)C)OC)OC)OC
InChI=1SC30H35NO5c1736259818(1226(25)334)211422201528(356)27(345)1319(20)101131(22)231630(23)1724(32)29(21)23h89121521H710111617H216H3
MFCD07638390
ZINC000013576687
ZINC000013576690

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Available files

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