Vitas-M small molecule compound

methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)propanoate

Catalog ID
STL549214
SMILES COC(=O)CC(c1cc2ccccc2n(c1=O)C)c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O

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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 C31H33N3O7 MW 559.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O7/c1-32-26-7-5-4-6-20(26)16-25(31(32)38)24(18-28(36)40-3)30-29(37)27(35)17-23(41-30)19-33-12-14-34(15-13-33)21-8-10-22(39-2)11-9-21/h4-11,16-17,24,37H,12-15,18-19H2,1-3H3
InChIKey
RFJBGLHMULHMGM-UHFFFAOYSA-N
Synonyms

110206910
InChI=1SC31H33N3O7c13226754620(26)1625(31(32)38)24(1828(36)403)3029(37)27(35)1723(4130)1933121434(151333)2181022(392)11921h41116172437H12151819H213H3
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(1methyl2oxo12dihydroquinolin3yl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3(1methyl2oxoquinolin3yl)propanoate
MFCD29055906
ZINC000253412510
ZINC000253412511

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Available files

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