Structure Database (LMSD)

Common Name
Leucocyanidin
Systematic Name
Synonyms
LM ID
LMPK12020202
Formula
C15H14O7
Exact Mass
Calculate m/z
306.073955
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)
SBZWTSHAFILOTE-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H14O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,13-21H
SMILES (Click to copy)
C1(O)=CC2OC(C3C=CC(O)=C(O)C=3)C(O)C(O)C=2C(O)=C1

Other Databases

Wikipedia
Leucocyanidin
CHEBI ID
15758
METABOLOMICS ID
FL6DACNS0001
PubChem CID
71629

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 254.87
Topological Polar Surface Area 132.68
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 7
logP 1.32
Molar Refractivity 74.39

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Updated at
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