Structure Database (LMSD)
Common Name
Deutzioside
Systematic Name
Synonyms
3D model of Deutzioside
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
QSOURIMNVDBNHL-HJJINUIOSA-N
InChi (Click to copy)
InChI=1S/C15H22O9/c1-4-3-21-14(7-6(4)9(18)13-12(7)23-13)24-15-11(20)10(19)8(17)5(2-16)22-15/h3,5-20H,2H2,1H3/t5-,6-,7+,8-,9+,10+,11-,12-,13+,14+,15+/m1/s1
SMILES (Click to copy)
O([C@@H]1OC=C(C)[C@@]2([H])[C@H](O)[C@@H]3O[C@@H]3[C@]21[H])[C@H]1[C@H](O)[C@H]([C@H](O)[C@H](O1)CO)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
24
Rings
4
Aromatic Rings
0
Rotatable Bonds
3
Van der Waals Molecular Volume
295.09
Topological Polar Surface Area
145.51
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
9
logP
0.30
Molar Refractivity
80.23
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Created at
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Updated at
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