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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 14:14, 5 December 2011 (Saving copy of the {{chembox}} taken from revid 444066147 of page Prephytoene_diphosphate for the Chem/Drugbox validation project (updated: 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 14:14, 5 December 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 444066147 of page Prephytoene_diphosphate for the Chem/Drugbox validation project (updated: 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 444066147 of page Prephytoene_diphosphate with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name -2-cyclopropyl]methyl phosphono hydrogen phosphate
Other names Prephytoene pyrophosphate
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
PubChem CID
InChI
  • InChI=1S/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+Key: RVCNKTPCHZNAAO-QKUGLALCSA-N
  • InChI=1/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/b33-21+,34-22+,35-25+,36-27+,37-29+Key: RVCNKTPCHZNAAO-QKUGLALCBM
SMILES
  • O=P(O)(O)OP(=O)(O)OCC1C(\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)C1(CC/C=C(/CC\C=C(/C)CC\C=C(/C)C)C)C
Properties
Chemical formula C40H68O7P2
Molar mass 722.91 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound