Vitas-M small molecule compound

methyl (3R)-2-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate

Catalog ID
STL457246
SMILES COC(=O)[C@H]1Cc2c(CN1C(=O)COc1ccc3c(c1)oc(=O)cc3C)[nH]c1c2cccc1

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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 C25H22N2O6 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6/c1-14-9-24(29)33-22-10-15(7-8-16(14)22)32-13-23(28)27-12-20-18(11-21(27)25(30)31-2)17-5-3-4-6-19(17)26-20/h3-10,21,26H,11-13H2,1-2H3/t21-/m1/s1
InChIKey
WNAYNBDAJBVOPW-OAQYLSRUSA-N
Synonyms

(S)methyl2(2((4methyl2oxo2Hchromen7yl)oxy)acetyl)2349tetrahydro1Hpyrido(34b)indole3carboxylate
CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CC4=C(CC3C(=O)OC)C5=CC=CC=C5N4
COC(=O)(C@@H)1Cc2c(CN1C(=O)COc1ccc3c(c1)oc(=O)cc3C)(nH)c1c2cccc1
COC(=O)(C@H)1Cc2c(CN1C(=O)COc1ccc3c(c1)oc(=O)cc3C)(nH)c1c2cccc1
InChI=1SC25H22N2O6c114924(29)33221015(7816(14)22)321323(28)27122018(1121(27)25(30)312)17534619(17)2620h3102126H1113H212H3t21m1s1
methyl(3R)2(((4methyl2oxo2Hchromen7yl)oxy)acetyl)2349tetrahydro1Hbetacarboline3carboxylate
methyl(3R)2(2(4methyl2oxochromen7yl)oxyacetyl)1349tetrahydropyrido(34b)indole3carboxylate
MFCD03851798
ZINC000002150224
ZINC02150224
ZINC2150224

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Available files

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