Structure Database (LMSD)

Common Name
Physcion
Systematic Name
1,8-dihydroxy-3-methoxy-6-methyl-9,10-anthracenedione
Synonyms
  • Parietin
  • Rheochrysidin
LM ID
LMPK13040028
Status
Active
Exact Mass
Calculate m/z
284.068475
Formula


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MDLMOL SDF CSV TSV
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Main

Classification

String Representations

InChiKey (Click to copy)
FFWOKTFYGVYKIR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H12O5/c1-7-3-9-13(11(17)4-7)16(20)14-10(15(9)19)5-8(21-2)6-12(14)18/h3-6,17-18H,1-2H3
SMILES (Click to copy)
C12C(O)=CC(C)=CC=1C(=O)C1=C(C(O)=CC(OC)=C1)C2=O

References

Reference
Anthraquinones from the seeds of Cassia tora with inhibitory activity on protein glycation and aldose reductase.
Biol Pharm Bull, 2007
DOI: 10.1248/bpb.30.2207
PMID: 17978503

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Senna tora (#362788)
Magnoliopsida (#3398)
Anthraquinones from the seeds of Cassia tora with inhibitory activity on protein glycation and aldose reductase.,
Biol Pharm Bull, 2007
Pubmed ID: 17978503

Other Databases

KEGG ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 3
Aromatic Rings 2
Rotatable Bonds 1
Van der Waals Molecular Volume 249.31
Topological Polar Surface Area 83.83
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
logP 2.19
Molar Refractivity 74.37

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Created at
19th Apr 2021
Updated at
19th Apr 2021