Vitas-M small molecule compound
methyl 3-(6-{[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4-methoxyphenyl)propanoate
Catalog ID
STL542827
SMILES COc1ccc(cc1)C(c1oc(CN2CCc3c(C2c2cc(OC)c(c(c2)OC)OC)cc(c(c3)OC)OC)cc(=O)c1O)CC(=O)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 C37H41NO11 MW 675.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H41NO11/c1-42-24-10-8-21(9-11-24)27(19-33(40)47-6)36-35(41)28(39)17-25(49-36)20-38-13-12-22-14-29(43-2)30(44-3)18-26(22)34(38)23-15-31(45-4)37(48-7)32(16-23)46-5/h8-11,14-18,27,34,41H,12-13,19-20H2,1-7H3InChIKey
PBUXVBGWWDWTBF-UHFFFAOYSA-NSynonyms
110208082
InChI=1SC37H41NO11c1422410821(91124)27(1933(40)476)3635(41)28(39)1725(4936)20381312221429(432)30(443)1826(22)34(38)231531(454)37(487)32(1623)465h8111418273441H12131920H217H3
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(4methoxyphenyl)propanoate
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(4methoxyphenyl)propanoate
MFCD29056453
ZINC000253411766
ZINC000253411771
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