The IUPAC name of the compound is N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-pentoxyoxan-3-yl]acetamide.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C13H25NO6/c1-3-4-5-6-19-13-10(14-8(2)16)12(18)11(17)9(7-15)20-13/h9-13,15,17-18H,3-7H2,1-2H3,(H,14,16)/t9-,10-,11-,12-,13-/m1/s1.
What is the InChIKey of the compound?
The InChIKey of the compound is TXAKGSVWAUXDOK-SYLRKERUSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CCCCCOC1C(C(C(C(O1)CO)O)O)NC(=O)C.
What is the isomeric SMILES of the compound?
The isomeric SMILES of the compound is CCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C.
What is the molecular weight of the compound?
The molecular weight of the compound is 291.34 g/mol.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is -0.3.
How many hydrogen bond donor counts does the compound have?
The compound has 4 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 6 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 7 rotatable bond counts.
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