Vitas-M small molecule compound
4-[3-(4-hydroxy-3-methoxyphenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoic acid
Catalog ID
STK549077
SMILES COc1cc(ccc1O)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C(=O)O)c1ccccc1
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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 C25H20N2O7 MW 460.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O7/c1-33-19-13-15(9-12-18(19)28)21-20-22(34-27(21)17-5-3-2-4-6-17)24(30)26(23(20)29)16-10-7-14(8-11-16)25(31)32/h2-13,20-22,28H,1H3,(H,31,32)InChIKey
RMGGVRKIYNZARK-UHFFFAOYSA-NSynonyms
1022305-08-31022305083
4(3(4HYDROXY3METHOXYPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZOICACID
4(3(4hydroxy3methoxyphenyl)46dioxo2phenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoicacid
4(3(4hydroxy3methoxyphenyl)46dioxo2phenyltetrahydro2Hpyrrolo(34d)isoxazol5(3H)yl)benzoicacid
COC1=C(C=CC(=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)ON2C5=CC=CC=C5)O
InChI=1SC25H20N2O7c133191315(91218(19)28)212022(3427(21)175324617)24(30)26(23(20)29)1610714(81116)25(31)32h213202228H1H3(H3132)
MFCD03673371
ZINC000009075850
ZINC000137384951
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