Vitas-M small molecule compound
(2E)-4-[(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)amino]-4-oxobut-2-enoic acid
Catalog ID
STL512890
SMILES OC(=O)/C=C/C(=O)Nc1ccc2c(c1)nc1c(n2)c(=O)n(c(=O)n1C)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 C16H13N5O5 MW 355.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5O5/c1-20-14-13(15(25)21(2)16(20)26)18-9-4-3-8(7-10(9)19-14)17-11(22)5-6-12(23)24/h3-7H,1-2H3,(H,17,22)(H,23,24)/b6-5+InChIKey
JVCQIJODMUKXHI-AATRIKPKSA-NSynonyms
1643660-52-9(~(E))4((13dimethyl24dioxobenzo(g)pteridin8yl)amino)4oxobut2enoicacid
(2E)4((13dimethyl24dioxo1234tetrahydrobenzo(g)pteridin8yl)amino)4oxobut2enoicacid
(E)4((13dimethyl24dioxo1234tetrahydrobenzo(g)pteridin8yl)amino)4oxobut2enoicacid
(E)4((13DIMETHYL24DIOXOBENZO(G)PTERIDIN8YL)AMINO)4OXOBUT2ENOICACID
1047662
1643660529
InChI=1SC16H13N5O5c1201413(15(25)21(2)16(20)26)189438(710(9)1914)1711(22)5612(23)24h37H12H3(H1722)(H2324)b65+
MFCD00844809
OC(=O)C=CC(=O)Nc1ccc2c(c1)nc1c(n2)c(=O)n(c(=O)n1C)C
ZINC000000723627
ZINC723627
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