Vitas-M small molecule compound
methyl 2-amino-1'-(2-ethoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Catalog ID
STK729806
SMILES CCOC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)OC1=C2C(=O)CCC1)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 C22H22N2O7 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7/c1-3-30-16(26)11-24-13-8-5-4-7-12(13)22(21(24)28)17-14(25)9-6-10-15(17)31-19(23)18(22)20(27)29-2/h4-5,7-8H,3,6,9-11,23H2,1-2H3InChIKey
WELJMKPVKOZYKL-UHFFFAOYSA-NSynonyms
(S)methyl2amino1(2ethoxy2oxoethyl)25dioxo5678tetrahydrospiro(chromene43indoline)3carboxylate
CCOC(=O)CN1C2=CC=CC=C2C3(C1=O)C4=C(CCCC4=O)OC(=C3C(=O)OC)N
CCOC(=O)CN1c2ccccc2(C@@)2(C1=O)C(=C(N)OC1=C2C(=O)CCC1)C(=O)OC
InChI=1SC22H22N2O7c133016(26)112413854712(13)22(21(24)28)1714(25)961015(17)3119(23)18(22)20(27)292h4578H3691123H212H3
methyl2amino1(2ethoxy2oxoethyl)25dioxo125678hexahydrospiro(chromene43indole)3carboxylate
METHYL2AMINO1(2ETHOXY2OXOETHYL)25DIOXOSPIRO(78DIHYDRO6HCHROMENE43INDOLE)3CARBOXYLATE
MFCD07210515
ZINC000002373635
ZINC000009319094
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