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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 09:23, 21 November 2011 (Saving copy of the {{chembox}} taken from revid 461733743 of page Huperzine_A 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 09:23, 21 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 461733743 of page Huperzine_A 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 461733743 of page Huperzine_A with values updated to verified values.
Huperzine A
Huperzine A
Huperzine A 3d
Names
IUPAC name (1R,9S,13E)- 1-Amino- 13-ethylidene- 11-methyl- 6-azatricyclo trideca- 2(7),3,10- trien- 5-one
Other names HupA
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
DrugBank
InChI
  • InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+/t10-,15+/m0/s1Key: ZRJBHWIHUMBLCN-YQEJDHNASA-N
  • InChI=1/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+/t10-,15+/m0/s1Key: ZRJBHWIHUMBLCN-YQEJDHNABN
SMILES
  • C\C2=C\\3CC=1NC(=O)\C=C/C=1(N)(C2)C/3=C\C
Properties
Chemical formula C15H18N2O
Molar mass 242.32 g/mol
Melting point 217–219 °C
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