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Concept information

Preferred term

doronine  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30ClNO8

inchi

  • InChI=1S/C21H30ClNO8/c1-12-10-21(28,13(2)22)19(27)30-16-7-9-23(5)8-6-15(17(16)25)11-29-18(26)20(12,4)31-14(3)24/h6,12-13,16,28H,7-11H2,1-5H3/b15-6-/t12-,13-,16-,20-,21+/m1/s1

inchikey

  • VGRSISYREBBIAL-XAHVSKGQSA-N

mass

  • 459.919

monoisotopicmass

  • 459.16599

smiles

  • C[C@@H](Cl)[C@@]1(O)C[C@@H](C)[C@@](C)(OC(C)=O)C(=O)OC/C2=C/CN(C)CC[C@@H](OC1=O)C2=O

subset

  • 2_STAR

synonym EXACT

  • Doronine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:4701

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