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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 12:36, 24 November 2011 (Saving copy of the {{chembox}} taken from revid 400314321 of page Migrastatin for the Chem/Drugbox validation project (updated: 'ChEMBL').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 12:36, 24 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 400314321 of page Migrastatin for the Chem/Drugbox validation project (updated: 'ChEMBL').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 400314321 of page Migrastatin with values updated to verified values.
Migrastatin
Migrastatin
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
InChI
  • InChI=1S/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1Key: OGYMUMAKGYYNHV-IJMHZYIBSA-N
  • InChI=1/C27H39NO7/c1-17-14-18(2)27(35-25(32)13-8-6-5-7-12-22(34-4)26(17)33)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14-/t17-,19-,22+,26+,27+/m1/s1Key: OGYMUMAKGYYNHV-IJMHZYIBBB
SMILES
  • C1/C=C(\(OC(=O)/C=C/CC/C=C/(1O)OC)(C)C(=O)CCCC2CC(=O)NC(=O)C2)/C
Properties
Chemical formula C27H39NO7
Molar mass 489.60 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