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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 10:03, 20 February 2012 (Saving copy of the {{chembox}} taken from revid 468556698 of page Stigmatellin 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 10:03, 20 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 468556698 of page Stigmatellin 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 468556698 of page Stigmatellin with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
MeSH Stigmatellin
PubChem CID
InChI
  • InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1Key: UZHDGDDPOPDJGM-CVOZLMQJSA-N
  • InChI=1/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1Key: UZHDGDDPOPDJGM-CVOZLMQJBZ
SMILES
  • O=C\1c2c(O/C(=C/1C)CC(C)(OC)(C)(OC)\C=C\C=C\C(=C\C)C)c(O)c(OC)cc2OC
Properties
Chemical formula C30H42O7
Molar mass 514.65 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
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