(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol

C7H14O5 — CID 93090180

IUPAC(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol
SMILESCO[C@H]1O[C@@H](CO)C[C@H](O)[C@@H]1O
InChIInChI=1S/C7H14O5/c1-11-7-6(10)5(9)2-4(3-8)12-7/h4-10H,2-3H2,1H3/t4-,5+,6+,7+/m1/s1
InChIKeyARNZRNVPEASSLV-BWBBJGPYSA-N
MW178.18 g/mol
LogP-1.54
Rot. Bonds2

About (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol

(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol (PubChem CID 93090180) has the molecular formula C7H14O5 and a molecular weight of 178.18 g/mol. Its IUPAC name is (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol.

Molecular Properties

Compound Name(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol
PubChem CID93090180
Molecular FormulaC7H14O5
Molecular Weight178.18 g/mol
Exact Mass178.08
IUPAC Name(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol
SMILESCO[C@H]1O[C@@H](CO)C[C@H](O)[C@@H]1O
InChIInChI=1S/C7H14O5/c1-11-7-6(10)5(9)2-4(3-8)12-7/h4-10H,2-3H2,1H3/t4-,5+,6+,7+/m1/s1
InChIKeyARNZRNVPEASSLV-BWBBJGPYSA-N
XLogP-1.54
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.18
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol?
The IUPAC name of (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol (CID 93090180) is (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol.
What is the SMILES notation for (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol?
The canonical SMILES for (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol is CO[C@H]1O[C@@H](CO)C[C@H](O)[C@@H]1O.
What is the InChIKey of (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol?
The InChIKey is ARNZRNVPEASSLV-BWBBJGPYSA-N. The full InChI is InChI=1S/C7H14O5/c1-11-7-6(10)5(9)2-4(3-8)12-7/h4-10H,2-3H2,1H3/t4-,5+,6+,7+/m1/s1.
What are the key properties of (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol?
(2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol has a molecular weight of 178.18 g/mol, XLogP of -1.54, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4S,6R)-6-(hydroxymethyl)-2-methoxyoxane-3,4-diol is sourced from PubChem (CID 93090180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).