Vitas-M small molecule compound

1-(1,1,2,3,3,6-hexamethyl-2,3-dihydro-1H-inden-5-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone

Catalog ID
STL526307
SMILES COc1c2c(CCN(C2CC(=O)c2cc3c(cc2C)C(C(C3(C)C)C)(C)C)C)cc2c1OCO2

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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 C29H37NO4 MW 463.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37NO4/c1-16-11-20-21(29(5,6)17(2)28(20,3)4)13-19(16)23(31)14-22-25-18(9-10-30(22)7)12-24-26(27(25)32-8)34-15-33-24/h11-13,17,22H,9-10,14-15H2,1-8H3
InChIKey
KFDBHIJGICYITQ-UHFFFAOYSA-N
Synonyms
895905-62-1
1(112336hexamethyl2~(H)inden5yl)2(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)ethanone
1(112336hexamethyl23dihydro1Hinden5yl)2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanone
3333282
895905621
InChI=1SC29H37NO4c116112021(29(56)17(2)28(203)4)1319(16)23(31)14222518(91030(22)7)122426(27(25)328)34153324h11131722H9101415H218H3
MFCD02115689
ZINC000020111943
ZINC000072330370

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Available files

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