Vitas-M small molecule compound
6-(4,6-dioxo-2,5-diphenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)-2,3-dimethoxybenzoic acid
Catalog ID
STK557491
SMILES COc1c(OC)ccc(c1C(=O)O)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)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 C26H22N2O7 MW 474.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O7/c1-33-18-14-13-17(19(26(31)32)22(18)34-2)21-20-23(35-28(21)16-11-7-4-8-12-16)25(30)27(24(20)29)15-9-5-3-6-10-15/h3-14,20-21,23H,1-2H3,(H,31,32)InChIKey
JUMCWXATNOIGLB-UHFFFAOYSA-NSynonyms
1022034-28-11022034281
6(46DIOXO25DIPHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)23DIMETHOXYBENZOICACID
6(46dioxo25diphenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)23dimethoxybenzoicacid
6(46dioxo25diphenylhexahydro2Hpyrrolo(34d)isoxazol3yl)23dimethoxybenzoicacid
COC1=C(C(=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC=C4)ON2C5=CC=CC=C5)C(=O)O)OC
InChI=1SC26H22N2O7c13318141317(19(26(31)32)22(18)342)212023(3528(21)16117481216)25(30)27(24(20)29)1595361015h314202123H12H3(H3132)
MFCD04025727
ZINC000009424685
ZINC000137793626
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