3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol

C140H186O26Si3 — CID 90745856

IUPAC3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol
SMILESC1=CC(OCc2ccccc2)C(OCc2ccccc2)C(COCc2ccccc2)O1.CC(C)[Si](OCC1OC=CC(O)C1O)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H](OCc3ccccc3)C2OCc2ccccc2)C1OCc1ccccc1)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)C2O)C1O)(C(C)C)C(C)C
InChIInChI=1S/C56H70O9Si.C42H58O9Si.C27H28O4.C15H30O4Si/c1-41(2)66(42(3)4,43(5)6)63-40-50-52(59-35-45-24-14-8-15-25-45)49(32-33-58-50)64-56-55(62-38-48-30-20-11-21-31-48)54(61-37-47-28-18-10-19-29-47)53(60-36-46-26-16-9-17-27-46)51(65-56)39-57-34-44-22-12-7-13-23-44;1-29(2)52(30(3)4,31(5)6)49-28-36-38(43)35(22-23-46-36)50-42-39(44)41(48-26-34-20-14-9-15-21-34)40(47-25-33-18-12-8-13-19-33)37(51-42)27-45-24-32-16-10-7-11-17-32;1-4-10-22(11-5-1)18-28-21-26-27(31-20-24-14-8-3-9-15-24)25(16-17-29-26)30-19-23-12-6-2-7-13-23;1-10(2)20(11(3)4,12(5)6)19-9-14-15(17)13(16)7-8-18-14/h7-33,41-43,49-56H,34-40H2,1-6H3;7-23,29-31,35-44H,24-28H2,1-6H3;1-17,25-27H,18-21H2;7-8,10-17H,9H2,1-6H3/t49?,50?,51?,52?,53-,54-,55?,56-;35?,36?,37?,38?,39?,40-,41-,42-;;/m11../s1
InChIKeyHQWCKBQBXSIGNK-DZQSEAQGSA-N
MW2369.26 g/mol
LogP27.17
Rot. Bonds58

About 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol

3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol (PubChem CID 90745856) has the molecular formula C140H186O26Si3 and a molecular weight of 2369.26 g/mol. Its IUPAC name is 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol.

Molecular Properties

Compound Name3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol
PubChem CID90745856
Molecular FormulaC140H186O26Si3
Molecular Weight2369.26 g/mol
Exact Mass2367.25
IUPAC Name3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol
SMILESC1=CC(OCc2ccccc2)C(OCc2ccccc2)C(COCc2ccccc2)O1.CC(C)[Si](OCC1OC=CC(O)C1O)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H](OCc3ccccc3)C2OCc2ccccc2)C1OCc1ccccc1)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)C2O)C1O)(C(C)C)C(C)C
InChIInChI=1S/C56H70O9Si.C42H58O9Si.C27H28O4.C15H30O4Si/c1-41(2)66(42(3)4,43(5)6)63-40-50-52(59-35-45-24-14-8-15-25-45)49(32-33-58-50)64-56-55(62-38-48-30-20-11-21-31-48)54(61-37-47-28-18-10-19-29-47)53(60-36-46-26-16-9-17-27-46)51(65-56)39-57-34-44-22-12-7-13-23-44;1-29(2)52(30(3)4,31(5)6)49-28-36-38(43)35(22-23-46-36)50-42-39(44)41(48-26-34-20-14-9-15-21-34)40(47-25-33-18-12-8-13-19-33)37(51-42)27-45-24-32-16-10-7-11-17-32;1-4-10-22(11-5-1)18-28-21-26-27(31-20-24-14-8-3-9-15-24)25(16-17-29-26)30-19-23-12-6-2-7-13-23;1-10(2)20(11(3)4,12(5)6)19-9-14-15(17)13(16)7-8-18-14/h7-33,41-43,49-56H,34-40H2,1-6H3;7-23,29-31,35-44H,24-28H2,1-6H3;1-17,25-27H,18-21H2;7-8,10-17H,9H2,1-6H3/t49?,50?,51?,52?,53-,54-,55?,56-;35?,36?,37?,38?,39?,40-,41-,42-;;/m11../s1
InChIKeyHQWCKBQBXSIGNK-DZQSEAQGSA-N
XLogP27.17
TPSA283.98 Ų
H-Bond Donors4
H-Bond Acceptors26
Rotatable Bonds58
Heavy Atoms169
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002369.26
LogP ≤ 527.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol?
The IUPAC name of 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol (CID 90745856) is 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol.
What is the SMILES notation for 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol?
The canonical SMILES for 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol is C1=CC(OCc2ccccc2)C(OCc2ccccc2)C(COCc2ccccc2)O1.CC(C)[Si](OCC1OC=CC(O)C1O)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H](OCc3ccccc3)C2OCc2ccccc2)C1OCc1ccccc1)(C(C)C)C(C)C.CC(C)[Si](OCC1OC=CC(O[C@@H]2OC(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)C2O)C1O)(C(C)C)C(C)C.
What is the InChIKey of 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol?
The InChIKey is HQWCKBQBXSIGNK-DZQSEAQGSA-N. The full InChI is InChI=1S/C56H70O9Si.C42H58O9Si.C27H28O4.C15H30O4Si/c1-41(2)66(42(3)4,43(5)6)63-40-50-52(59-35-45-24-14-8-15-25-45)49(32-33-58-50)64-56-55(62-38-48-30-20-11-21-31-48)54(61-37-47-28-18-10-19-29-47)53(60-36-46-26-16-9-17-27-46)51(65-56)39-57-34-44-22-12-7-13-23-44;1-29(2)52(30(3)4,31(5)6)49-28-36-38(43)35(22-23-46-36)50-42-39(44)41(48-26-34-20-14-9-15-21-34)40(47-25-33-18-12-8-13-19-33)37(51-42)27-45-24-32-16-10-7-11-17-32;1-4-10-22(11-5-1)18-28-21-26-27(31-20-24-14-8-3-9-15-24)25(16-17-29-26)30-19-23-12-6-2-7-13-23;1-10(2)20(11(3)4,12(5)6)19-9-14-15(17)13(16)7-8-18-14/h7-33,41-43,49-56H,34-40H2,1-6H3;7-23,29-31,35-44H,24-28H2,1-6H3;1-17,25-27H,18-21H2;7-8,10-17H,9H2,1-6H3/t49?,50?,51?,52?,53-,54-,55?,56-;35?,36?,37?,38?,39?,40-,41-,42-;;/m11../s1.
What are the key properties of 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol?
3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol has a molecular weight of 2369.26 g/mol, XLogP of 27.17, 58 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran;(2R,4R,5R)-2-[[3-hydroxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-ol;[3-phenylmethoxy-4-[(2R,4R,5R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane;2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-3,4-diol is sourced from PubChem (CID 90745856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).