Structure Database (LMSD)

Common Name
Lucidone
Systematic Name
Synonyms
LM ID
LMPK12120439
Formula
C15H12O4
Exact Mass
Calculate m/z
256.07356
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Flavonoids [PK12]
Chalcones and dihydrochalcones [PK1212]

References

Taxonomy Information

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

String Representations

InChiKey (Click to copy)
WVXIJNYYNKDLPE-UWWXTLEHSA-N
InChi (Click to copy)
InChI=1S/C15H12O4/c1-19-13-9-12(17)14(15(13)18)11(16)8-7-10-5-3-2-4-6-10/h2-9,16H,1H3/b8-7+,14-11-
SMILES (Click to copy)
C1(OC)C(=O)/C(=C(/C=C/C2C=CC=CC=2)\O)/C(=O)C=1

Other Databases

METABOLOMICS ID
FL1CUNNS0003
PubChem CID
11253859

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 2
Aromatic Rings 1
Rotatable Bonds 3
Van der Waals Molecular Volume 246.48
Topological Polar Surface Area 63.60
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
logP 2.19
Molar Refractivity 70.24

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Updated at
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