Vitas-M small molecule compound
methyl 2-amino-4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL175781
SMILES COC(=O)C1=C(N)OC2=C(C1c1cc(COc3c(OC)cccc3OC)c(cc1C)C)C(=O)CCC2
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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 C28H31NO7 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO7/c1-15-12-16(2)18(13-17(15)14-35-26-21(32-3)10-7-11-22(26)33-4)23-24-19(30)8-6-9-20(24)36-27(29)25(23)28(31)34-5/h7,10-13,23H,6,8-9,14,29H2,1-5H3InChIKey
JXKBNANGRPROQO-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1C2C3=C(CCCC3=O)OC(=C2C(=O)OC)N)COC4=C(C=CC=C4OC)OC)C
InChI=1SC28H31NO7c1151216(2)18(1317(15)14352621(323)1071122(26)334)232419(30)86920(24)3627(29)25(23)28(31)345h7101323H6891429H215H3
methyl2amino4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)5oxo4678tetrahydrochromene3carboxylate
methyl2amino4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)5oxo5678tetrahydro4Hchromene3carboxylate
MFCD03074842
ZINC000002749422
ZINC000002749423
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