Revision as of 13:32, 1 November 2010 edit Beetstra (talk \| contribs) Edit filter managers, Administrators 171,941 edits Script assisted update of identifiers from ChemSpider, CommonChemistry and FDA for the Chem/Drugbox validation project - Updated: ChemSpiderID InChI1 InChIKey1 SMILES. ← Previous edit		Revision as of 14:26, 2 December 2010 edit undo Beetstra (talk \| contribs) Edit filter managers, Administrators 171,941 edits Script assisted update of identifiers from ChemSpider, CommonChemistry and FDA for the Chem/Drugbox validation project - Updated: InChI1->InChI StdInChI StdInChIKey. Next edit →
Line 6: \|Section1={{Chembox Identifiers \| ChemSpiderID = 102755 \| ~~InChI1~~InChI = 1/C20H26O3/c1-18-7-5-16-14(6-9-23-16)15(18)4-8-19-10-13(2-3-17(18)19)20(22,11-19)12-21/h5-7,9,13,15,17,21-22H,2-4,8,10-12H2,1H3/t13-,15-,17+,18-,19+,20+/m1/s1 \| ~~InChIKey1~~InChIKey = JEKMKNDURXDJAD-HWUKTEKMBU \| StdInChI = 1S/C20H26O3/c1-18-7-5-16-14(6-9-23-16)15(18)4-8-19-10-13(2-3-17(18)19)20(22,11-19)12-21/h5-7,9,13,15,17,21-22H,2-4,8,10-12H2,1H3/t13-,15-,17+,18-,19+,20+/m1/s1 \| StdInChIKey = JEKMKNDURXDJAD-HWUKTEKMSA-N \| CASNo=6894-43-5 \| PubChem=114778

Kahweol: Difference between revisions