Structure Database (LMSD)

Common Name
6-Hydroxyluteolin 6,3'-dimethyl eter 5-rhamnoside
Systematic Name
Synonyms
LM ID
LMPK12111224
Formula
C23H24O11
Exact Mass
Calculate m/z
476.131865
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

Biological Context

References

Taxonomy Information

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

String Representations

InChiKey (Click to copy)
WUKBFIRBKFQFOI-YZVSBERFSA-N
InChi (Click to copy)
InChI=1S/C23H24O11/c1-9-18(27)19(28)20(29)23(32-9)34-22-17-12(25)7-14(10-4-5-11(24)15(6-10)30-2)33-16(17)8-13(26)21(22)31-3/h4-9,18-20,23-24,26-29H,1-3H3/t9-,18-,19+,20+,23-/m0/s1
SMILES (Click to copy)
C1C=C(O)C(OC)=CC=1C1=CC(=O)C2C(O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)=C(OC)C(O)=CC=2O1

Other Databases

METABOLOMICS ID
FL3FECGS0051
PubChem CID
127035287

Calculated Physicochemical Properties

Heavy Atoms 34
Rings 4
Aromatic Rings 3
Rotatable Bonds 5
Van der Waals Molecular Volume 399.89
Topological Polar Surface Area 170.35
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 11
logP 3.43
Molar Refractivity 120.00

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Created at
-
Updated at
21st Dec 2021