Vitas-M small molecule compound

N-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]aspartic acid

Catalog ID
STK571596
SMILES OC(=O)CC(C(=O)O)NC=C1C(=O)N(C)C(=O)N(C1=O)C

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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 C11H13N3O7 MW 299.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3O7/c1-13-8(17)5(9(18)14(2)11(13)21)4-12-6(10(19)20)3-7(15)16/h4,6,12H,3H2,1-2H3,(H,15,16)(H,19,20)
InChIKey
WEAOUENLECIWGA-UHFFFAOYSA-N
Synonyms

2(((13DIMETHYL246TRIOXO13DIHYDROPYRIMIDIN5YLIDENE)METHYL)AMINO)BUTANEDIOICACID
2(((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)succinicacid
2((13DIMETHYL246TRIOXO13DIAZINAN5YLIDENE)METHYLAMINO)BUTANEDIOICACID
CN1C(=O)C(=CNC(CC(=O)O)C(=O)O)C(=O)N(C1=O)C
InChI=1SC11H13N3O7c1138(17)5(9(18)14(2)11(13)21)4126(10(19)20)37(15)16h4612H3H212H3(H1516)(H1920)
MFCD00844995
N((13DIMETHYL246TRIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)ASPARTICACID
N((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)asparticacid
ZINC000001000543
ZINC000001000544

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Available files

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