Structure Database (LMSD)

Common Name
Naringenin
Systematic Name
Synonyms
LM ID
LMPK12140001
Status
Active
Exact Mass
Calculate m/z
272.068475
Formula
C15H12O5
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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

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

String Representations

InChiKey (Click to copy)
FTVWIRXFELQLPI-ZDUSSCGKSA-N
InChi (Click to copy)
InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1
SMILES (Click to copy)
C1(O)C=C2O[C@H](C3=CC=C(O)C=C3)CC(=O)C2=C(O)C=1

References

Other Databases

Wikipedia
Naringenin
KEGG ID
C00509
HMDB ID
HMDB0002670
CHEBI ID
17846
PubChem CID
439246

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 234.65
Topological Polar Surface Area 89.06
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
logP 2.51
Molar Refractivity 70.19

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Updated at
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