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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 07:35, 18 February 2012 (Saving copy of the {{chembox}} taken from revid 470965034 of page Limonin for the Chem/Drugbox validation project (updated: 'ChEBI', 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 07:35, 18 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 470965034 of page Limonin for the Chem/Drugbox validation project (updated: 'ChEBI', 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 470965034 of page Limonin with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name 7,16-Dioxo-7,16-dideoxylimondiol
Other names limonoate D-ring-lactone,
limonoic acid di-delta-lactone
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
PubChem CID
InChI
  • InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1Key: KBDSLGBFQAGHBE-MSGMIQHVSA-N
  • InChI=1/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1Key: KBDSLGBFQAGHBE-MSGMIQHVBF
SMILES
  • O=C46(C)72O7C(=O)O(c1ccoc1)2(C)CC635COC(=O)C5OC(3C4)(C)C
Properties
Chemical formula C26H30O8
Molar mass 470.52 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
Chemical compound
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