(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol

C10H16O6 — CID 101077453

IUPAC(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol
SMILESO[C@H]1CO[C@]2(CO[C@]3(CO2)C[C@@H](O)CO3)C1
InChIInChI=1S/C10H16O6/c11-7-1-9(13-3-7)5-16-10(6-15-9)2-8(12)4-14-10/h7-8,11-12H,1-6H2/t7-,8-,9-,10+/m1/s1
InChIKeyMFWNKUIDGSGXMP-KYXWUPHJSA-N
MW232.23 g/mol
LogP-1.01
Rot. Bonds

About (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol

(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol (PubChem CID 101077453) has the molecular formula C10H16O6 and a molecular weight of 232.23 g/mol. Its IUPAC name is (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol.

Molecular Properties

Compound Name(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol
PubChem CID101077453
Molecular FormulaC10H16O6
Molecular Weight232.23 g/mol
Exact Mass232.09
IUPAC Name(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol
SMILESO[C@H]1CO[C@]2(CO[C@]3(CO2)C[C@@H](O)CO3)C1
InChIInChI=1S/C10H16O6/c11-7-1-9(13-3-7)5-16-10(6-15-9)2-8(12)4-14-10/h7-8,11-12H,1-6H2/t7-,8-,9-,10+/m1/s1
InChIKeyMFWNKUIDGSGXMP-KYXWUPHJSA-N
XLogP-1.01
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol?
The IUPAC name of (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol (CID 101077453) is (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol.
What is the SMILES notation for (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol?
The canonical SMILES for (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol is O[C@H]1CO[C@]2(CO[C@]3(CO2)C[C@@H](O)CO3)C1.
What is the InChIKey of (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol?
The InChIKey is MFWNKUIDGSGXMP-KYXWUPHJSA-N. The full InChI is InChI=1S/C10H16O6/c11-7-1-9(13-3-7)5-16-10(6-15-9)2-8(12)4-14-10/h7-8,11-12H,1-6H2/t7-,8-,9-,10+/m1/s1.
What are the key properties of (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol?
(2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol has a molecular weight of 232.23 g/mol, XLogP of -1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R,8S,10R)-4,7,12,14-tetraoxadispiro[4.2.48.25]tetradecane-2,10-diol is sourced from PubChem (CID 101077453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).