[(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten

C18H33O9PW2-2 — CID 59991686

About [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten

[(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten (PubChem CID 59991686) has the molecular formula C18H33O9PW2-2 and a molecular weight of 792.11 g/mol. Its IUPAC name is [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten.

Molecular Properties

• Compound Name: [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten
• PubChem CID: 59991686
• Molecular Formula: C18H33O9PW2-2
• Molecular Weight: 792.11 g/mol
• Exact Mass: 792.09
• IUPAC Name: [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten
• SMILES: CC(C)OC[C@H]1O[C@@H](C)[C@@H](O)C1OP(=O)([O-])O[CH-][C@H]1O[C@@H](C)CC1OC(C)C.[W].[W]
• InChI: InChI=1S/C18H34O9P.2W/c1-10(2)22-8-16-18(17(19)13(6)26-16)27-28(20,21)23-9-15-14(24-11(3)4)7-12(5)25-15;;/h9-19H,7-8H2,1-6H3,(H,20,21);;/q-1;;/p-1/t12-,13-,14?,15+,16+,17+,18?;;/m0../s1
• InChIKey: JUJYGTYCXOAOEE-LFKMBZRJSA-M
• XLogP: 1.56
• TPSA: 115.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 10
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	792.11
LogP ≤ 5	1.56
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten?

The IUPAC name of [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten (CID 59991686) is [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten.

What is the SMILES notation for [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten?

The canonical SMILES for [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten is CC(C)OC[C@H]1O[C@@H](C)[C@@H](O)C1OP(=O)([O-])O[CH-][C@H]1O[C@@H](C)CC1OC(C)C.[W].[W].

What is the InChIKey of [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten?

The InChIKey is JUJYGTYCXOAOEE-LFKMBZRJSA-M. The full InChI is InChI=1S/C18H34O9P.2W/c1-10(2)22-8-16-18(17(19)13(6)26-16)27-28(20,21)23-9-15-14(24-11(3)4)7-12(5)25-15;;/h9-19H,7-8H2,1-6H3,(H,20,21);;/q-1;;/p-1/t12-,13-,14?,15+,16+,17+,18?;;/m0../s1.

What are the key properties of [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten?

[(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten has a molecular weight of 792.11 g/mol, XLogP of 1.56, 10 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R,4R,5S)-4-hydroxy-5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl] [(2R,5S)-5-methyl-3-propan-2-yloxyoxolan-2-yl]methyl phosphate;tungsten is sourced from PubChem (CID 59991686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).