(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol

C5H10O5 — CID 158521049

IUPAC(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol
SMILES[2H]C([2H])(O)[C@H]1OC(O)C(O)[C@@]1([2H])O
InChIInChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3+,4?,5?/m1/s1/i1D2,3D
InChIKeyHMFHBZSHGGEWLO-YLLSAPGPSA-N
MW153.15 g/mol
LogP-2.58
Rot. Bonds1

About (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol

(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol (PubChem CID 158521049) has the molecular formula C5H10O5 and a molecular weight of 153.15 g/mol. Its IUPAC name is (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol.

Molecular Properties

Compound Name(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol
PubChem CID158521049
Molecular FormulaC5H10O5
Molecular Weight153.15 g/mol
Exact Mass153.07
IUPAC Name(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol
SMILES[2H]C([2H])(O)[C@H]1OC(O)C(O)[C@@]1([2H])O
InChIInChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3+,4?,5?/m1/s1/i1D2,3D
InChIKeyHMFHBZSHGGEWLO-YLLSAPGPSA-N
XLogP-2.58
TPSA90.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.15
LogP ≤ 5-2.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol?
The IUPAC name of (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol (CID 158521049) is (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol.
What is the SMILES notation for (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol?
The canonical SMILES for (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol is [2H]C([2H])(O)[C@H]1OC(O)C(O)[C@@]1([2H])O.
What is the InChIKey of (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol?
The InChIKey is HMFHBZSHGGEWLO-YLLSAPGPSA-N. The full InChI is InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3+,4?,5?/m1/s1/i1D2,3D.
What are the key properties of (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol?
(4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol has a molecular weight of 153.15 g/mol, XLogP of -2.58, 1 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-4-deuterio-5-[dideuterio(hydroxy)methyl]oxolane-2,3,4-triol is sourced from PubChem (CID 158521049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).