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Concept information

Preferred term

spiroscytalin  

Type

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

Broader concept

charge

  • 0

formula

  • C22H27NO2

inchi

  • InChI=1S/C22H27NO2/c1-14-7-6-10-17-12-11-15(2)22(19(14)17)20(24)18(23-21(22)25)13-16-8-4-3-5-9-16/h3-5,8-9,11-12,14-15,17-19H,6-7,10,13H2,1-2H3,(H,23,25)/t14-,15-,17+,18+,19+,22-/m0/s1

inchikey

  • ZUCYLMDAXHXTEP-BWGSOXPZSA-N

mass

  • 337.463

monoisotopicmass

  • 337.20418

smiles

  • O=C1N[C@H](CC2=CC=CC=C2)C([C@]13[C@H]4[C@@H](C=C[C@@H]3C)CCC[C@@H]4C)=O

subset

  • 2_STAR

synonym EXACT

  • (4S,4aR,5S,5'R,6S,8aR)-5'-benzyl-4,6-dimethylspiro[2,3,4,4a,6,8a-hexahydro-1H-naphthalene-5,3'-pyrrolidine]-2',4'-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224941

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