Structure Database (LMSD)

Common Name
6-C-Fucopyranosylluteolin
Systematic Name
Synonyms
LM ID
LMPK12110475
Formula
C21H20O10
Exact Mass
Calculate m/z
432.10565
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Flavonoids [PK12]
Flavones and Flavonols [PK1211]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Viridiplantae (#33090)
Flavonoid imported from http://metabolomics.jp/

String Representations

InChiKey (Click to copy)
ROQHTXBYBLROKW-DXUFBRRUSA-N
InChi (Click to copy)
InChI=1S/C21H20O10/c1-7-17(26)19(28)20(29)21(30-7)16-12(25)6-14-15(18(16)27)11(24)5-13(31-14)8-2-3-9(22)10(23)4-8/h2-7,17,19-23,25-29H,1H3/t7-,17+,19+,20-,21+/m0/s1
SMILES (Click to copy)
O[C@H]1[C@H](O)[C@H](O)[C@H](C)O[C@@H]1C1C(=CC2=C(C=1O)C(C=C(O2)C1=CC=C(C(=C1)O)O)=O)O

Other Databases

METABOLOMICS ID
FL3FACCS0007
PubChem CID
44257912

Calculated Physicochemical Properties

Heavy Atoms 31
Rings 4
Aromatic Rings 3
Rotatable Bonds 2
Van der Waals Molecular Volume 356.50
Topological Polar Surface Area 183.12
Hydrogen Bond Donors 7
Hydrogen Bond Acceptors 10
logP 2.87
Molar Refractivity 108.04

Admin

Created at
-
Updated at
22nd Dec 2021