Vitas-M small molecule compound
3-butyl-5-(3-butyl-2-hydroxy-7-methoxy-4-oxo-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-5-yl)-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL058201
SMILES CCCCn1c(O)nc2c(c1=O)C(c1c(O2)ccc(c1)OC)c1c(=O)[nH]c(=O)n(c1[O-])CCCC
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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 C24H27N4O7 MW 483.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O7/c1-4-6-10-27-21(30)17(19(29)25-23(27)32)16-14-12-13(34-3)8-9-15(14)35-20-18(16)22(31)28(11-7-5-2)24(33)26-20/h8-9,12,16,30H,4-7,10-11H2,1-3H3,(H,26,33)(H,25,29,32)/p-1InChIKey
XRJZRPZEJUOIBO-UHFFFAOYSA-MSynonyms
3butyl5(3butyl2hydroxy7methoxy4oxo35dihydro4Hchromeno(23d)pyrimidin5yl)26dioxo1236tetrahydropyrimidin4olate
3BUTYL5(3BUTYL7METHOXY24DIOXO15DIHYDROCHROMENO(23D)PYRIMIDIN5YL)26DIOXOPYRIMIDIN4OLATE
CCCCN1C(=C(C(=O)NC1=O)C2C3=C(C=CC(=C3)OC)OC4=C2C(=O)N(C(=O)N4)CCCC)(O)
CCCCn1c(O)nc2c(c1=O)C(c1c(O2)ccc(c1)OC)c1c(=O)(nH)c(=O)n(c1(O))CCCC
InChI=1SC24H28N4O7c146102721(30)17(19(29)2523(27)32)16141213(343)8915(14)352018(16)22(31)28(11752)24(33)2620h89121630H471011H213H3(H2633)(H252932)p1
ZINC000009329728
ZINC000016956685
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