(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol

C48H84O50 — CID 162129284

About (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol

(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol (PubChem CID 162129284) has the molecular formula C48H84O50 and a molecular weight of 1461.15 g/mol. Its IUPAC name is (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol.

Molecular Properties

• Compound Name: (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol
• PubChem CID: 162129284
• Molecular Formula: C48H84O50
• Molecular Weight: 1461.15 g/mol
• Exact Mass: 1460.40
• IUPAC Name: (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol
• SMILES: O=C=O.O=C=O.O=C=O.O=C=O.OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@](CO)(O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O.O[C@@H]1[C@@H](O)[C@@H](O)OC[C@H]1O
• InChI: InChI=1S/2C11H20O10.2C6H12O6.2C5H10O5.4CO2/c12-1-5-7(16)9(18)11(3-13,20-5)21-10-8(17)6(15)4(14)2-19-10;12-1-3-5(14)7(16)9(18)11(19-3)21-10-8(17)6(15)4(2-13)20-10;7-1-3-4(9)5(10)6(11,2-8)12-3;7-1-2-3(8)4(9)5(10)6(11)12-2;6-2-1-10-5(9)4(8)3(2)7;6-1-2-3(7)4(8)5(9)10-2;4*2-1-3/h4-10,12-18H,1-3H2;3-18H,1-2H2;3-5,7-11H,1-2H2;2-11H,1H2;2*2-9H,1H2;;;;/t4-,5-,6+,7-,8-,9+,10-,11+;3-,4-,5-,6-,7+,8+,9-,10+,11-;3-,4-,5+,6-;2-,3-,4+,5-,6+;2-,3+,4-,5+;2-,3-,4+,5-;;;;/m111111..../s1
• InChIKey: ZILKNXYRWRHQPX-ZQLFSQSJSA-N
• XLogP: -23.45
• TPSA: 876.22 Ų
• H-Bond Donors: 32
• H-Bond Acceptors: 50
• Rotatable Bonds: 12
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1461.15
LogP ≤ 5	-23.45
H-Bond Donors ≤ 5	32
H-Bond Acceptors ≤ 10	50

Frequently Asked Questions

What is the IUPAC name of (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol?

The IUPAC name of (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol (CID 162129284) is (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol.

What is the SMILES notation for (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol?

The canonical SMILES for (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol is O=C=O.O=C=O.O=C=O.O=C=O.OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@](CO)(O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O.O[C@@H]1[C@@H](O)[C@@H](O)OC[C@H]1O.

What is the InChIKey of (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol?

The InChIKey is ZILKNXYRWRHQPX-ZQLFSQSJSA-N. The full InChI is InChI=1S/2C11H20O10.2C6H12O6.2C5H10O5.4CO2/c12-1-5-7(16)9(18)11(3-13,20-5)21-10-8(17)6(15)4(14)2-19-10;12-1-3-5(14)7(16)9(18)11(19-3)21-10-8(17)6(15)4(2-13)20-10;7-1-3-4(9)5(10)6(11,2-8)12-3;7-1-2-3(8)4(9)5(10)6(11)12-2;6-2-1-10-5(9)4(8)3(2)7;6-1-2-3(7)4(8)5(9)10-2;4*2-1-3/h4-10,12-18H,1-3H2;3-18H,1-2H2;3-5,7-11H,1-2H2;2-11H,1H2;2*2-9H,1H2;;;;/t4-,5-,6+,7-,8-,9+,10-,11+;3-,4-,5-,6-,7+,8+,9-,10+,11-;3-,4-,5+,6-;2-,3-,4+,5-,6+;2-,3+,4-,5+;2-,3-,4+,5-;;;;/m111111..../s1.

What are the key properties of (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol?

(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol has a molecular weight of 1461.15 g/mol, XLogP of -23.45, 12 rotatable bonds, 32 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;tetrakis(carbon dioxide);(2R,3R,4S,5R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol;(2R,3S,4S,5R)-5-(hydroxymethyl)oxolane-2,3,4-triol;(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol is sourced from PubChem (CID 162129284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).