triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane

C48H104O9Si6 — CID 10996702

IUPACtriethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane
SMILESCC[Si](CC)(CC)OC[C@H]1O[C@@H](O[C@H]2[C@H](O[Si](CC)(CC)CC)C=CO[C@@H]2CO[Si](CC)(CC)CC)[C@H](O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@H]1O[Si](CC)(CC)CC
InChIInChI=1S/C48H104O9Si6/c1-19-58(20-2,21-3)50-39-42-44(41(37-38-49-42)54-60(25-7,26-8)27-9)53-48-47(57-63(34-16,35-17)36-18)46(56-62(31-13,32-14)33-15)45(55-61(28-10,29-11)30-12)43(52-48)40-51-59(22-4,23-5)24-6/h37-38,41-48H,19-36,39-40H2,1-18H3/t41-,42-,43-,44+,45+,46+,47-,48+/m1/s1
InChIKeyQRYFDKOWNPRWKP-BKDSWPARSA-N
MW993.87 g/mol
LogP14.61
Rot. Bonds34

About triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane

triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane (PubChem CID 10996702) has the molecular formula C48H104O9Si6 and a molecular weight of 993.87 g/mol. Its IUPAC name is triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane.

Molecular Properties

Compound Nametriethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane
PubChem CID10996702
Molecular FormulaC48H104O9Si6
Molecular Weight993.87 g/mol
Exact Mass992.63
IUPAC Nametriethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane
SMILESCC[Si](CC)(CC)OC[C@H]1O[C@@H](O[C@H]2[C@H](O[Si](CC)(CC)CC)C=CO[C@@H]2CO[Si](CC)(CC)CC)[C@H](O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@H]1O[Si](CC)(CC)CC
InChIInChI=1S/C48H104O9Si6/c1-19-58(20-2,21-3)50-39-42-44(41(37-38-49-42)54-60(25-7,26-8)27-9)53-48-47(57-63(34-16,35-17)36-18)46(56-62(31-13,32-14)33-15)45(55-61(28-10,29-11)30-12)43(52-48)40-51-59(22-4,23-5)24-6/h37-38,41-48H,19-36,39-40H2,1-18H3/t41-,42-,43-,44+,45+,46+,47-,48+/m1/s1
InChIKeyQRYFDKOWNPRWKP-BKDSWPARSA-N
XLogP14.61
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds34
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500993.87
LogP ≤ 514.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The IUPAC name of triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane (CID 10996702) is triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane.
What is the SMILES notation for triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The canonical SMILES for triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane is CC[Si](CC)(CC)OC[C@H]1O[C@@H](O[C@H]2[C@H](O[Si](CC)(CC)CC)C=CO[C@@H]2CO[Si](CC)(CC)CC)[C@H](O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@H]1O[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The InChIKey is QRYFDKOWNPRWKP-BKDSWPARSA-N. The full InChI is InChI=1S/C48H104O9Si6/c1-19-58(20-2,21-3)50-39-42-44(41(37-38-49-42)54-60(25-7,26-8)27-9)53-48-47(57-63(34-16,35-17)36-18)46(56-62(31-13,32-14)33-15)45(55-61(28-10,29-11)30-12)43(52-48)40-51-59(22-4,23-5)24-6/h37-38,41-48H,19-36,39-40H2,1-18H3/t41-,42-,43-,44+,45+,46+,47-,48+/m1/s1.
What are the key properties of triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane has a molecular weight of 993.87 g/mol, XLogP of 14.61, 34 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[[(2R,3R,4R)-2-(triethylsilyloxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]oxy]silane is sourced from PubChem (CID 10996702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).