2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol

C10H10O11 — CID 67296177

IUPAC2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol
SMILESOC1=C(O)C(O)=C(O)C(OC2OC(O)=C(O)C(O)=C2O)O1
InChIInChI=1S/C10H10O11/c11-1-3(13)7(17)19-9(5(1)15)21-10-6(16)2(12)4(14)8(18)20-10/h9-18H
InChIKeyZGZQGOALKORMFR-UHFFFAOYSA-N
MW306.18 g/mol
LogP0.94
Rot. Bonds2

About 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol

2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol (PubChem CID 67296177) has the molecular formula C10H10O11 and a molecular weight of 306.18 g/mol. Its IUPAC name is 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol.

Molecular Properties

Compound Name2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol
PubChem CID67296177
Molecular FormulaC10H10O11
Molecular Weight306.18 g/mol
Exact Mass306.02
IUPAC Name2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol
SMILESOC1=C(O)C(O)=C(O)C(OC2OC(O)=C(O)C(O)=C2O)O1
InChIInChI=1S/C10H10O11/c11-1-3(13)7(17)19-9(5(1)15)21-10-6(16)2(12)4(14)8(18)20-10/h9-18H
InChIKeyZGZQGOALKORMFR-UHFFFAOYSA-N
XLogP0.94
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 ≤ 50.94
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1011

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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
Pyrano[3,2-d][1,3]dioxine-7,8-diol
CID 69082707
2-ethoxy-2H-pyran-3,4-diol
CID 70378262
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-(2,3,4,5-Tetrahydroxypyran-2-yl)oxypyran-2,3,4,5-tetrol
CID 87344276
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
2-prop-2-ynoxy-2H-pyran-3,4,5,6-tetrol
CID 149909734
2,3-dihydroperoxy-4-(3-hydroxypropoxy)-2H-pyran-5,6-diol
CID 172395691

Frequently Asked Questions

What is the IUPAC name of 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol?
The IUPAC name of 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol (CID 67296177) is 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol.
What is the SMILES notation for 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol?
The canonical SMILES for 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol is OC1=C(O)C(O)=C(O)C(OC2OC(O)=C(O)C(O)=C2O)O1.
What is the InChIKey of 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol?
The InChIKey is ZGZQGOALKORMFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O11/c11-1-3(13)7(17)19-9(5(1)15)21-10-6(16)2(12)4(14)8(18)20-10/h9-18H.
What are the key properties of 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol?
2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol has a molecular weight of 306.18 g/mol, XLogP of 0.94, 2 rotatable bonds, 8 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,4,5,6-tetrahydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3,4,5,6-tetrol is sourced from PubChem (CID 67296177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).