2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol

C10H10O11 — CID 87344276

IUPAC2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol
SMILESOC1=COC(O)(OC2(O)OC=C(O)C(O)=C2O)C(O)=C1O
InChIInChI=1S/C10H10O11/c11-3-1-19-9(17,7(15)5(3)13)21-10(18)8(16)6(14)4(12)2-20-10/h1-2,11-18H
InChIKeySYESKMWFURNCGU-UHFFFAOYSA-N
MW306.18 g/mol
LogP-0.19
Rot. Bonds2

About 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol

2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol (PubChem CID 87344276) has the molecular formula C10H10O11 and a molecular weight of 306.18 g/mol. Its IUPAC name is 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol.

Molecular Properties

Compound Name2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol
PubChem CID87344276
Molecular FormulaC10H10O11
Molecular Weight306.18 g/mol
Exact Mass306.02
IUPAC Name2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol
SMILESOC1=COC(O)(OC2(O)OC=C(O)C(O)=C2O)C(O)=C1O
InChIInChI=1S/C10H10O11/c11-3-1-19-9(17,7(15)5(3)13)21-10(18)8(16)6(14)4(12)2-20-10/h1-2,11-18H
InChIKeySYESKMWFURNCGU-UHFFFAOYSA-N
XLogP-0.19
TPSA189.53 Ų
H-Bond Donors8
H-Bond Acceptors11
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500306.18
LogP ≤ 5-0.19
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[(5,6-dihydroxy-4-methoxy-2H-pyran-2-yl)oxy]-4-methoxy-2H-pyran-5,6-diol
CID 67084747
6-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-2,3,4,5-tetrol
CID 67296174
2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol
CID 67296177
Pyrano[3,2-d][1,3]dioxine-7,8-diol
CID 69082707
6-[(3,4-dihydroxy-2H-pyran-2-yl)oxy]-2H-pyran-4,5-diol
CID 70378264
2-[(3,4-dihydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4-diol
CID 70378269
2-(2,3-Dihydroxypyran-2-yl)oxypyran-2,3-diol
CID 88619295
2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol
CID 141292094

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol?
The IUPAC name of 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol (CID 87344276) is 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol.
What is the SMILES notation for 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol?
The canonical SMILES for 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol is OC1=COC(O)(OC2(O)OC=C(O)C(O)=C2O)C(O)=C1O.
What is the InChIKey of 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol?
The InChIKey is SYESKMWFURNCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O11/c11-3-1-19-9(17,7(15)5(3)13)21-10(18)8(16)6(14)4(12)2-20-10/h1-2,11-18H.
What are the key properties of 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol?
2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol has a molecular weight of 306.18 g/mol, XLogP of -0.19, 2 rotatable bonds, 8 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,4,5-tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol is sourced from PubChem (CID 87344276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).