Vitas-M small molecule compound
2-{[(3-carboxy-2,2-dimethylcyclopropyl)carbonyl]amino}-4,5-dimethoxybenzoic acid
Catalog ID
STL155861
SMILES COc1cc(NC(=O)C2C(C2(C)C)C(=O)O)c(cc1OC)C(=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 C16H19NO7 MW 337.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO7/c1-16(2)11(12(16)15(21)22)13(18)17-8-6-10(24-4)9(23-3)5-7(8)14(19)20/h5-6,11-12H,1-4H3,(H,17,18)(H,19,20)(H,21,22)InChIKey
TVSWPPPVFDBABX-UHFFFAOYSA-NSynonyms
1324077-67-91324077679
2(((3carboxy22dimethylcyclopropyl)carbonyl)amino)45dimethoxybenzoicacid
2((3carboxy22dimethylcyclopropanecarbonyl)amino)45dimethoxybenzoicacid
2(3carboxy22dimethylcyclopropanecarboxamido)45dimethoxybenzoicacid
CC1(C(C1C(=O)O)C(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC)C
InChI=1SC16H19NO7c116(2)11(12(16)15(21)22)13(18)178610(244)9(233)57(8)14(19)20h561112H14H3(H1718)(H1920)(H2122)
MFCD19708728
ZINC000071280097
ZINC000071280100
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