Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK398539
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1ccc2c(c1)OCO2
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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 C15H15NO6 MW 305.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO6/c17-14(12-9-3-4-10(22-9)13(12)15(18)19)16-7-1-2-8-11(5-7)21-6-20-8/h1-2,5,9-10,12-13H,3-4,6H2,(H,16,17)(H,18,19)InChIKey
GZIZQJIGTHWOFL-UHFFFAOYSA-NSynonyms
2(13BENZODIOXOL5YLCARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3(13benzodioxol5ylcarbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(2HBENZO(D)13DIOXOLAN5YL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
C1CC2C(C(C1O2)C(=O)NC3=CC4=C(C=C3)OCO4)C(=O)O
InChI=1SC15H15NO6c1714(1293410(229)13(12)15(18)19)16712811(57)216208h1259101213H346H2(H1617)(H1819)
MFCD01924186
ZINC000225887711
ZINC000239308818
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