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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 14:49, 10 January 2012 (Saving copy of the {{chembox}} taken from revid 464791970 of page Urobilin 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 14:49, 10 January 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 464791970 of page Urobilin 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 464791970 of page Urobilin with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Identifiers
3D model (JSmol)
ChemSpider
MeSH Urobilin
PubChem CID
InChI
  • InChI=1S/C33H42N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h15,26-27,35H,7-14H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b28-15-/t26-,27-/m0/s1Key: KDCCOOGTVSRCHX-UYMYUHGCSA-N
  • InChI=1/C33H42N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h15,26-27,35H,7-14H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b28-15-/t26-,27-/m0/s1Key: KDCCOOGTVSRCHX-UYMYUHGCBF
SMILES
  • O=C1/C(=C(/CC)(N1)Cc2c(c(c(n2)\C=C3/N=C(\C(=C3CCC(=O)O)C)C/4NC(=O)\C(=C\4C)CC)CCC(=O)O)C)C
Properties
Chemical formula C33H42N4O6
Molar mass 590.71
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