Vitas-M small molecule compound
3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]propanamide
Catalog ID
STL551058
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NCc1c2CCN(Cc2c(c2c1OCO2)OC)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 C29H32N2O9 MW 552.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O9/c1-15-9-22(33)25(35)26(40-15)18(16-5-6-21(32)23(10-16)36-3)11-24(34)30-12-19-17-7-8-31(2)13-20(17)27(37-4)29-28(19)38-14-39-29/h5-6,9-10,18,32,35H,7-8,11-14H2,1-4H3,(H,30,34)InChIKey
KETRIXRSPNMILX-UHFFFAOYSA-NSynonyms
127253851
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)~(N)((4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin9yl)methyl)propanamide
InChI=1SC29H32N2O9c115922(33)25(35)26(4015)18(165621(32)23(1016)363)1124(34)301219177831(2)1320(17)27(374)2928(19)38143929h56910183235H781114H214H3(H3034)
MFCD31757925
ZINC000604404155
ZINC000604404157
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