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Concept information

Preferred term

(16S) deshydroxymethyl stemmadenine (1+)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • +1

formula

  • C20H25N2O2

inchi

  • InChI=1S/C20H24N2O2/c1-3-13-12-22-10-8-14(13)18(20(23)24-2)19-16(9-11-22)15-6-4-5-7-17(15)21-19/h3-7,14,18,21H,8-12H2,1-2H3/p+1/b13-3-/t14-,18-/m0/s1

inchikey

  • FWGFCRSCPPSXQL-IPPALFRBSA-O

mass

  • 325.425

monoisotopicmass

  • 325.19105

smiles

  • C12=C(C=CC=C1)NC=3[C@H]([C@@]4(/C(/C[NH+](CC4)CCC32)=C/C)[H])C(=O)OC

subset

  • 3_STAR

synonym EXACT

  • (5E,6R,7S)-5-ethylidene-7-(methoxycarbonyl)-1,2,3,4,5,6,7,8-octahydro-3,6-ethanoazonino[5,4-b]indol-3-ium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:142671

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