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Concept information

Preferred term

0231b  

Type

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

Broader concept

charge

  • 0

formula

  • C21H17NO3

inchi

  • InChI=1S/C21H17NO3/c1-11-9-12-7-8-15(23)19-17(12)14(10-11)22-20(19)13-5-4-6-16(24-2)18(13)21(22)25-3/h4-10,21H,1-3H3/t21-/m0/s1

inchikey

  • RIHDHRTVCCUKQG-NRFANRHFSA-N

mass

  • 331.371

monoisotopicmass

  • 331.12084

smiles

  • O=C1C2=C3N([C@@H](OC)C4=C3C=CC=C4OC)C=5C2=C(C=C(C)C5)C=C1

subset

  • 2_STAR

synonym EXACT

  • (9S)-7,9-dimethoxy-13-methyl-10-azapentacyclo[9.7.1.02,10.03,8.015,19]nonadeca-1,3(8),4,6,11,13,15(19),16-octaen-18-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220826

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