Structure Database (LMSD)
Common Name
Naringenin 5-O-rhamnoside
Systematic Name
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Naringenin 5-O-rhamnoside
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
OVWZFLKQVPSRDZ-QMKCEKJGSA-N
InChi (Click to copy)
InChI=1S/C21H22O9/c1-9-18(25)19(26)20(27)21(28-9)30-16-7-12(23)6-15-17(16)13(24)8-14(29-15)10-2-4-11(22)5-3-10/h2-7,9,14,18-23,25-27H,8H2,1H3/t9-,14?,18-,19+,20+,21-/m0/s1
SMILES (Click to copy)
C1(O)=CC2OC(C3C=CC(O)=CC=3)CC(=O)C=2C(O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)=C1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Viridiplantae
(#33090)
Flavonoid imported from http://metabolomics.jp/
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
4
Aromatic Rings
2
Rotatable Bonds
3
Van der Waals Molecular Volume
361.25
Topological Polar Surface Area
150.05
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
9
logP
2.44
Molar Refractivity
104.07
Admin
Created at
-
Updated at
26th Oct 2021