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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 09:36, 20 February 2012 (Saving copy of the {{chembox}} taken from revid 449644957 of page Santin_(flavonol) for the Chem/Drugbox validation project (updated: 'ChEMBL', 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 09:36, 20 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 449644957 of page Santin_(flavonol) for the Chem/Drugbox validation project (updated: 'ChEMBL', 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 449644957 of page Santin_(flavonol) with values updated to verified values.
Santin
Chemical structure of santin
Chemical structure of santin
Names
IUPAC name 5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
Other names 5,7-Dihydroxy-3,6,4'-trimethoxyflavone
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
PubChem CID
InChI
  • InChI=1S/C18H16O7/c1-22-10-6-4-9(5-7-10)16-18(24-3)15(21)13-12(25-16)8-11(19)17(23-2)14(13)20/h4-8,19-20H,1-3H3Key: DWZAJFZEYZIHPO-UHFFFAOYSA-N
  • InChI=1/C18H16O7/c1-22-10-6-4-9(5-7-10)16-18(24-3)15(21)13-12(25-16)8-11(19)17(23-2)14(13)20/h4-8,19-20H,1-3H3Key: DWZAJFZEYZIHPO-UHFFFAOYAB
SMILES
  • COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)O)OC)O)OC
Properties
Chemical formula C18H16O7
Molar mass 344.31 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkverify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound
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