(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid

C12H20O12 — CID 159612670

IUPAC(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid
SMILESO=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O.O=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O
InChIInChI=1S/2C6H10O6/c2*7-2-1-12-5(3(2)8)4(9)6(10)11/h2*2-5,7-9H,1H2,(H,10,11)/t2*2-,3+,4-,5+/m11/s1
InChIKeyMMWXLXRLHHBDTQ-UJZJUORMSA-N
MW356.28 g/mol
LogP-4.89
Rot. Bonds4

About (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid

(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid (PubChem CID 159612670) has the molecular formula C12H20O12 and a molecular weight of 356.28 g/mol. Its IUPAC name is (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid.

Molecular Properties

Compound Name(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid
PubChem CID159612670
Molecular FormulaC12H20O12
Molecular Weight356.28 g/mol
Exact Mass356.10
IUPAC Name(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid
SMILESO=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O.O=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O
InChIInChI=1S/2C6H10O6/c2*7-2-1-12-5(3(2)8)4(9)6(10)11/h2*2-5,7-9H,1H2,(H,10,11)/t2*2-,3+,4-,5+/m11/s1
InChIKeyMMWXLXRLHHBDTQ-UJZJUORMSA-N
XLogP-4.89
TPSA214.44 Ų
H-Bond Donors8
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.28
LogP ≤ 5-4.89
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1010

Analyze (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid with MolForge

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

Launch Full Analysis

Related Compounds

sodium 2-hydroxy-2-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]acetate
CID 153429784
4-hydroxy-3-oxo-4-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]butanoic acid
CID 174050494
ethyl (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetate
CID 10856641
(2S,3S,4R)-2-[1,2-dihydroxy-2-[(2S,3S,4R)-3,4,5-trihydroxyoxan-2-yl]ethyl]oxane-3,4,5-triol
CID 57168192
(2S,3R,4S)-2-[(1R)-1-hydroxyethyl]oxolane-3,4-diol
CID 18667402
(2S,3R,4R,5S)-2-[chloro(hydroxy)methyl]oxane-3,4,5-triol
CID 54301911
(2S,3S,4S)-2-[(1S)-1,2-dihydroxyethyl]oxolane-3,4-diol
CID 11073753
(2S,3S,4S)-2-[hydroxy(phosphorosooxy)methyl]oxolane-3,4-diol
CID 91425120
[(2R)-2-[(2R,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] acetate
CID 118147027
(2R,3S,4R)-2-[(1S)-1-hydroxy-2,2-dimethoxyethyl]oxolane-3,4-diol
CID 162949873
(2R,3R,4S)-2-[(1S)-1-hydroxy-2,2-dimethoxyethyl]oxolane-3,4-diol
CID 20835708
2-(1-hydroxybutyl)oxolane-3,4-diol
CID 123496613

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid?
The IUPAC name of (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid (CID 159612670) is (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid.
What is the SMILES notation for (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid?
The canonical SMILES for (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid is O=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O.O=C(O)[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O.
What is the InChIKey of (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid?
The InChIKey is MMWXLXRLHHBDTQ-UJZJUORMSA-N. The full InChI is InChI=1S/2C6H10O6/c2*7-2-1-12-5(3(2)8)4(9)6(10)11/h2*2-5,7-9H,1H2,(H,10,11)/t2*2-,3+,4-,5+/m11/s1.
What are the key properties of (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid?
(2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid has a molecular weight of 356.28 g/mol, XLogP of -4.89, 4 rotatable bonds, 8 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2S,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid is sourced from PubChem (CID 159612670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).