(2S,4S,5S)-oxane-2,4,5-triol

C5H10O4 — CID 11859680

IUPAC(2S,4S,5S)-oxane-2,4,5-triol
SMILESO[C@@H]1C[C@H](O)[C@@H](O)CO1
InChIInChI=1S/C5H10O4/c6-3-1-5(8)9-2-4(3)7/h3-8H,1-2H2/t3-,4-,5-/m0/s1
InChIKeyZVQAVWAHRUNNPG-YUPRTTJUSA-N
MW134.13 g/mol
LogP-1.55
Rot. Bonds

About (2S,4S,5S)-oxane-2,4,5-triol

(2S,4S,5S)-oxane-2,4,5-triol (PubChem CID 11859680) has the molecular formula C5H10O4 and a molecular weight of 134.13 g/mol. Its IUPAC name is (2S,4S,5S)-oxane-2,4,5-triol.

Molecular Properties

Compound Name(2S,4S,5S)-oxane-2,4,5-triol
PubChem CID11859680
Molecular FormulaC5H10O4
Molecular Weight134.13 g/mol
Exact Mass134.06
IUPAC Name(2S,4S,5S)-oxane-2,4,5-triol
SMILESO[C@@H]1C[C@H](O)[C@@H](O)CO1
InChIInChI=1S/C5H10O4/c6-3-1-5(8)9-2-4(3)7/h3-8H,1-2H2/t3-,4-,5-/m0/s1
InChIKeyZVQAVWAHRUNNPG-YUPRTTJUSA-N
XLogP-1.55
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.13
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

D-Glucose
CID 5793
D-Fructose
CID 2723872
D-Xylose
CID 135191
D-Tagatose
CID 439312
D-Galactose
CID 6036
Hexose
CID 206
Beta-D-Glucose
CID 64689
beta-L-arabinopyranose
CID 439764
L-Fucose
CID 17106
Beta-D-Fructopyranose
CID 24310
beta-D-Galactopyranose
CID 439353
D-Ribose
CID 10975657

Frequently Asked Questions

What is the IUPAC name of (2S,4S,5S)-oxane-2,4,5-triol?
The IUPAC name of (2S,4S,5S)-oxane-2,4,5-triol (CID 11859680) is (2S,4S,5S)-oxane-2,4,5-triol.
What is the SMILES notation for (2S,4S,5S)-oxane-2,4,5-triol?
The canonical SMILES for (2S,4S,5S)-oxane-2,4,5-triol is O[C@@H]1C[C@H](O)[C@@H](O)CO1.
What is the InChIKey of (2S,4S,5S)-oxane-2,4,5-triol?
The InChIKey is ZVQAVWAHRUNNPG-YUPRTTJUSA-N. The full InChI is InChI=1S/C5H10O4/c6-3-1-5(8)9-2-4(3)7/h3-8H,1-2H2/t3-,4-,5-/m0/s1.
What are the key properties of (2S,4S,5S)-oxane-2,4,5-triol?
(2S,4S,5S)-oxane-2,4,5-triol has a molecular weight of 134.13 g/mol, XLogP of -1.55, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S,5S)-oxane-2,4,5-triol is sourced from PubChem (CID 11859680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).