Structure Database (LMSD)

OH O OH OH HO O
Common Name
Eriodictyol
Systematic Name
3',4',5,7-Tetrahydroxyflavanone
Synonyms
  • Huazhongilexone
  • (S) -2- (3,4-Dihydroxyphenyl) -2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one
LM ID
LMPK12140002
Formula
C15H12O6
Exact Mass
Calculate m/z
288.06339
Status
Active
Show lipids differing only in stereochemistry/bond geometry
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Main

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Flavonoids [PK12]
Flavanones [PK1214]

String Representations

InChiKey (Click to copy)
SBHXYTNGIZCORC-ZDUSSCGKSA-N
InChi (Click to copy)
InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2/t13-/m0/s1
SMILES (Click to copy)
C1(O)C=C2O[C@H](C3=CC=C(O)C(O)=C3)CC(=O)C2=C(O)C=1

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Eriodictyon californicum (#4132)
Magnoliopsida (#3398)
Isolation of potential cancer chemopreventive agents from Eriodictyon californicum.,
J Nat Prod, 1992
Pubmed ID: 1593282

Other Databases

Wikipedia
Eriodictyol
KEGG ID
C05631
HMDB ID
HMDB0005810
CHEBI ID
28412
PubChem CID
440735
Cayman ID
26803
PDB ID
ERD

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 243.44
Topological Polar Surface Area 109.29
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
logP 2.22
Molar Refractivity 71.86

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Created at
-
Updated at
20th Nov 2023