Vitas-M small molecule compound
3-(3-nitrophenyl)-6-(3,4,5-trimethoxyphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Catalog ID
STK914682
SMILES COc1cc(cc(c1OC)OC)c1cc(C(=O)O)c2c(n1)[nH]nc2c1cccc(c1)[N+](=O)[O-]
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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 C22H18N4O7 MW 450.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O7/c1-31-16-8-12(9-17(32-2)20(16)33-3)15-10-14(22(27)28)18-19(24-25-21(18)23-15)11-5-4-6-13(7-11)26(29)30/h4-10H,1-3H3,(H,27,28)(H,23,24,25)InChIKey
NRHZUWWJRGOJJN-UHFFFAOYSA-NSynonyms
3(3nitrophenyl)6(345trimethoxyphenyl)1Hpyrazolo(34b)pyridine4carboxylicacid
3(3nitrophenyl)6(345trimethoxyphenyl)2Hpyrazolo(34b)pyridine4carboxylicacid
COC1=CC(=CC(=C1OC)OC)C2=NC3=NNC(=C3C(=C2)C(=O)O)C4=CC(=CC=C4)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)c1cc(C(=O)O)c2c(n1)(nH)nc2c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H18N4O7c13116812(917(322)20(16)333)151014(22(27)28)1819(242521(18)2315)1154613(711)26(29)30h410H13H3(H2728)(H232425)
MFCD18175709
ZINC000020492280
ZINC20492280
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