About butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate
butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate (PubChem CID 158608174) has the molecular formula C166H214B8O62
and a molecular weight of 3287.97 g/mol. Its IUPAC name is butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate.
Frequently Asked Questions
What is the IUPAC name of butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate?
The IUPAC name of butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate (CID 158608174) is butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate.
What is the SMILES notation for butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate?
The canonical SMILES for butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate is C=C1OC(OC(=O)c2cccc3c2OB(O)[C@@H](CC(=O)CCC)C3)c2ccccc21.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2OB1O.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OCOC(=O)C(C)(C)OC)c2OB1O.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OCOC(=O)C(C)(C)OCC)c2OB1O.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OCOC(=O)OC(C)C)c2OB1O.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OCOC(=O)OC3CCCCC3)c2OB1O.CCCC(=O)C[C@H]1Cc2cccc(C(=O)OCOC(=O)OCC)c2OB1O.CCCCOC(=O)OCOC(=O)c1cccc2c1OB(O)[C@@H](CC(=O)CCC)C2.
What is the InChIKey of butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate?
The InChIKey is HWMNSNXDWGWBAX-DNLZNRRKSA-N. The full InChI is InChI=1S/C23H31BO8.C23H23BO6.C22H29BO8.C21H29BO8.2C20H27BO8.C19H25BO8.C18H23BO8/c1-3-8-18(25)14-17-13-16-9-7-12-20(21(16)32-24(17)28)22(26)29-15(2)30-23(27)31-19-10-5-4-6-11-19;1-3-7-17(25)13-16-12-15-8-6-11-20(21(15)30-24(16)27)22(26)29-23-19-10-5-4-9-18(19)14(2)28-23;1-2-7-17(24)13-16-12-15-8-6-11-19(20(15)31-23(16)27)21(25)28-14-29-22(26)30-18-9-4-3-5-10-18;1-5-8-16(23)12-15-11-14-9-7-10-17(18(14)30-22(15)26)19(24)27-13-28-20(25)21(3,4)29-6-2;1-5-7-15(22)11-14-10-13-8-6-9-16(17(13)29-21(14)25)18(23)27-12-28-19(24)20(2,3)26-4;1-3-5-10-26-20(24)28-13-27-19(23)17-9-6-8-14-11-15(12-16(22)7-4-2)21(25)29-18(14)17;1-4-6-15(21)10-14-9-13-7-5-8-16(17(13)28-20(14)24)18(22)25-11-26-19(23)27-12(2)3;1-3-6-14(20)10-13-9-12-7-5-8-15(16(12)27-19(13)23)17(21)25-11-26-18(22)24-4-2/h7,9,12,15,17,19,28H,3-6,8,10-11,13-14H2,1-2H3;4-6,8-11,16,23,27H,2-3,7,12-13H2,1H3;6,8,11,16,18,27H,2-5,7,9-10,12-14H2,1H3;7,9-10,15,26H,5-6,8,11-13H2,1-4H3;6,8-9,14,25H,5,7,10-12H2,1-4H3;6,8-9,15,25H,3-5,7,10-13H2,1-2H3;5,7-8,12,14,24H,4,6,9-11H2,1-3H3;5,7-8,13,23H,3-4,6,9-11H2,1-2H3/t15?,17-;16-,23?;16-;15-;14-;15-;14-;13-/m11111111/s1.
What are the key properties of butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate?
butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate has a molecular weight of 3287.97 g/mol, XLogP of 25.88, 67 rotatable bonds, 8 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for butoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;1-cyclohexyloxycarbonyloxyethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;cyclohexyloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;ethoxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-ethoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(2-methoxy-2-methylpropanoyl)oxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;(3-methylidene-1H-2-benzofuran-1-yl) (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate;propan-2-yloxycarbonyloxymethyl (3R)-2-hydroxy-3-(2-oxopentyl)-3,4-dihydro-1,2-benzoxaborinine-8-carboxylate is sourced from PubChem (CID 158608174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).