(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione

C4H4O6Sn — CID 124629764

IUPAC(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione
SMILESO=C1O[Sn]OC(=O)[C@H](O)[C@@H]1O
InChIInChI=1S/C4H6O6.Sn/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2/t1-,2+;
InChIKeyYXTDAZMTQFUZHK-NUGIMEKKSA-L
MW266.78 g/mol
LogP-2.66
Rot. Bonds

About (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione

(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione (PubChem CID 124629764) has the molecular formula C4H4O6Sn and a molecular weight of 266.78 g/mol. Its IUPAC name is (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione.

Molecular Properties

Compound Name(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione
PubChem CID124629764
Molecular FormulaC4H4O6Sn
Molecular Weight266.78 g/mol
Exact Mass267.90
IUPAC Name(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione
SMILESO=C1O[Sn]OC(=O)[C@H](O)[C@@H]1O
InChIInChI=1S/C4H6O6.Sn/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2/t1-,2+;
InChIKeyYXTDAZMTQFUZHK-NUGIMEKKSA-L
XLogP-2.66
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.78
LogP ≤ 5-2.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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(5S)-3,4,5,6-tetrahydroxyoxan-2-one
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Frequently Asked Questions

What is the IUPAC name of (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione?
The IUPAC name of (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione (CID 124629764) is (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione.
What is the SMILES notation for (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione?
The canonical SMILES for (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione is O=C1O[Sn]OC(=O)[C@H](O)[C@@H]1O.
What is the InChIKey of (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione?
The InChIKey is YXTDAZMTQFUZHK-NUGIMEKKSA-L. The full InChI is InChI=1S/C4H6O6.Sn/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+2/p-2/t1-,2+;.
What are the key properties of (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione?
(5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione has a molecular weight of 266.78 g/mol, XLogP of -2.66, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,6S)-5,6-dihydroxy-1,3,2λ2-dioxastannepane-4,7-dione is sourced from PubChem (CID 124629764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).