Structure Database (LMSD)

OH O OH OH OH OH HO O
Common Name
Dihydromyricetin
Systematic Name
Synonyms
LM ID
LMPK12113405
Formula
C15H12O8
Exact Mass
Calculate m/z
320.05322
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

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

String Representations

InChiKey (Click to copy)
KJXSIXMJHKAJOD-LSDHHAIUSA-N
InChi (Click to copy)
InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H/t14-,15+/m0/s1
SMILES (Click to copy)
C1(O)C=C2O[C@H](C3=CC(O)=C(O)C(O)=C3)[C@@H](O)C(=O)C2=C(O)C=1

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Nekemias grossedentata (#416090)
Magnoliopsida (#3398)
Optimizing the Maximum Recovery of Dihydromyricetin from Chinese Vine Tea, Ampelopsis grossedentata, Using Response Surface Methodology.,
Molecules, 2017
Pubmed ID: 29258286

Other Databases

KEGG ID
C02906
CHEBI ID
28429
PubChem CID
161557

Calculated Physicochemical Properties

Heavy Atoms 23
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 261.02
Topological Polar Surface Area 149.75
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 8
logP 1.18
Molar Refractivity 75.43

Admin

Created at
8th Jun 2021
Updated at
8th Jun 2021