Vitas-M small molecule compound
methyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Catalog ID
STK863678
SMILES COC(=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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-28-15(25)10-23-12-7-4-3-6-11(12)21(20(23)27)16-13(24)8-5-9-14(16)30-18(22)17(21)19(26)29-2/h3-4,6-7H,5,8-10,22H2,1-2H3InChIKey
JNUCAFKMPUFGFZ-UHFFFAOYSA-NSynonyms
(S)methyl2amino1(2methoxy2oxoethyl)25dioxo5678tetrahydrospiro(chromene43indoline)3carboxylate
COC(=O)CN1C2=CC=CC=C2C3(C1=O)C4=C(CCCC4=O)OC(=C3C(=O)OC)N
COC(=O)CN1c2ccccc2(C@@)2(C1=O)C(=C(N)OC1=C2C(=O)CCC1)C(=O)OC
InChI=1SC21H20N2O7c12815(25)102312743611(12)21(20(23)27)1613(24)85914(16)3018(22)17(21)19(26)292h3467H581022H212H3
methyl2amino1(2methoxy2oxoethyl)25dioxo125678hexahydrospiro(chromene43indole)3carboxylate
METHYL2AMINO1(2METHOXY2OXOETHYL)25DIOXOSPIRO(78DIHYDRO6HCHROMENE43INDOLE)3CARBOXYLATE
MFCD05025259
ZINC000002196507
ZINC000002482380
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