Vitas-M small molecule compound

methyl 2-amino-4-[2-(2-methoxy-2-oxoethoxy)phenyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STL371493
SMILES COC(=O)COc1ccccc1C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C(=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 C22H25NO7 MW 415.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO7/c1-22(2)9-13(24)18-15(10-22)30-20(23)19(21(26)28-4)17(18)12-7-5-6-8-14(12)29-11-16(25)27-3/h5-8,17H,9-11,23H2,1-4H3
InChIKey
PVBVETUIOYGSQI-UHFFFAOYSA-N
Synonyms

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC(=O)OC)C(=O)C1)C
InChI=1SC22H25NO7c122(2)913(24)1815(1022)3020(23)19(21(26)284)17(18)12756814(12)291116(25)273h5817H91123H214H3
METHYL2(2(2AMINO3(METHOXYCARBONYL)77DIMETHYL5OXO4H678TRIHYDROCHROMEN4YL)PHENOXY)ACETATE
methyl2amino4(2(2methoxy2oxoethoxy)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
METHYL2AMINO4(2(2METHOXY2OXOETHOXY)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
MFCD05819242
ZINC000000818764
ZINC000000818765

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Available files

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