About [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione
[3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione (PubChem CID 160525747) has the molecular formula C184H210O58
and a molecular weight of 3349.65 g/mol. Its IUPAC name is [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione.
Frequently Asked Questions
What is the IUPAC name of [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione?
The IUPAC name of [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione (CID 160525747) is [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione.
What is the SMILES notation for [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione?
The canonical SMILES for [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione is CC1C(OCc2ccccc2)C(O)OC2COC(c3ccccc3)OC21.CC1CC2COC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC2C(O)C1O.CC1OC(CO)C(O)C(C)C1OCc1ccccc1.COCOc1cc(C(=O)O)cc(C)c1C.COCOc1cc(C(=O)OCC2OC(C)C(OCc3ccccc3)C(C)C2OC(=O)c2cc(C)c(C)c(OCOC)c2)cc(C)c1C.Cc1c(O)cc(C(=O)OCC2OC(C)C(OCc3ccccc3)C(C)C2OC(=O)c2cc(O)c(C)c(O)c2)cc1O.Cc1c(O)cc2c(c1O)-c1c(cc(O)c(C)c1O)C(=O)OC1C(COC2=O)OC(C)C(OCc2ccccc2)C1C.Cc1cc(C(=O)O)cc(OCc2ccccc2)c1C.
What is the InChIKey of [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione?
The InChIKey is QUWBPFZYYJWTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H46O10.C31H32O10.C31H34O10.C22H22O12.C21H24O5.C16H16O3.C15H22O4.C11H14O4/c1-22-14-29(16-31(24(22)3)44-20-40-7)36(38)43-19-33-35(26(5)34(27(6)46-33)42-18-28-12-10-9-11-13-28)47-37(39)30-15-23(2)25(4)32(17-30)45-21-41-8;1-14-21(32)10-19-24(26(14)34)25-20(11-22(33)15(2)27(25)35)31(37)41-29-16(3)28(38-12-18-8-6-5-7-9-18)17(4)40-23(29)13-39-30(19)36;1-16-23(32)10-21(11-24(16)33)30(36)39-15-27-29(41-31(37)22-12-25(34)17(2)26(35)13-22)18(3)28(19(4)40-27)38-14-20-8-6-5-7-9-20;1-6-2-7-5-33-21(31)8-3-10(23)15(26)17(28)12(8)13-9(4-11(24)16(27)18(13)29)22(32)34-20(7)19(30)14(6)25;1-14-18-17(13-24-21(26-18)16-10-6-3-7-11-16)25-20(22)19(14)23-12-15-8-4-2-5-9-15;1-11-8-14(16(17)18)9-15(12(11)2)19-10-13-6-4-3-5-7-13;1-10-14(17)13(8-16)19-11(2)15(10)18-9-12-6-4-3-5-7-12;1-7-4-9(11(12)13)5-10(8(7)2)15-6-14-3/h9-17,26-27,33-35H,18-21H2,1-8H3;5-11,16-17,23,28-29,32-35H,12-13H2,1-4H3;5-13,18-19,27-29,32-35H,14-15H2,1-4H3;3-4,6-7,14,19-20,23-30H,2,5H2,1H3;2-11,14,17-22H,12-13H2,1H3;3-9H,10H2,1-2H3,(H,17,18);3-7,10-11,13-17H,8-9H2,1-2H3;4-5H,6H2,1-3H3,(H,12,13).
What are the key properties of [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione?
[3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione has a molecular weight of 3349.65 g/mol, XLogP of 25.90, 41 rotatable bonds, 21 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3,5-dihydroxy-4-methylbenzoyl)oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3,5-dihydroxy-4-methylbenzoate;3,4-dimethyl-5-phenylmethoxybenzoic acid;2-(hydroxymethyl)-4,6-dimethyl-5-phenylmethoxyoxan-3-ol;3-(methoxymethoxy)-4,5-dimethylbenzoic acid;[3-[3-(methoxymethoxy)-4,5-dimethylbenzoyl]oxy-4,6-dimethyl-5-phenylmethoxyoxan-2-yl]methyl 3-(methoxymethoxy)-4,5-dimethylbenzoate;8-methyl-2-phenyl-7-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-ol;3,4,5,11,12,21,22,23-octahydroxy-13-methyl-9,17-dioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione;3,5,21,23-tetrahydroxy-4,11,13,22-tetramethyl-12-phenylmethoxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione is sourced from PubChem (CID 160525747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).