Structure Database (LMSD)

Common Name
Luteoforol
Systematic Name
Synonyms
LM ID
LMPK12020170
Formula
C15H14O6
Exact Mass
Calculate m/z
290.07904
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Flavonoids [PK12]
Flavans, Flavanols and Leucoanthocyanidins [PK1202]

References

Taxonomy Information

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

String Representations

InChiKey (Click to copy)
FSYDWKPCKNCRDI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H14O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,12-13,16-20H,6H2
SMILES (Click to copy)
C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)CC(O)C=2C(O)=C1

Other Databases

Wikipedia
Luteoforol
HMDB ID
HMDB0041310
METABOLOMICS ID
FL64ACNS0001
PubChem CID
114505

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 246.08
Topological Polar Surface Area 112.45
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 6
logP 2.07
Molar Refractivity 72.49

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Updated at
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