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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

LSM 42290  

Type

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

charge

  • 0

formula

  • C23H31N3O5

inchi

  • InChI=1S/C23H31N3O5/c1-25-13-11-17-9-10-19(29-3)20(31-17)15-30-22-16(14-24)6-4-7-18(22)23(28)26(2)12-5-8-21(25)27/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20-/m0/s1

inchikey

  • KLTTUROVXNDFDZ-IHPCNDPISA-N

mass

  • 429.510

monoisotopicmass

  • 429.22637

smiles

  • CN1CC[C@@H]2CC[C@@H]([C@@H](O2)COC3=C(C=CC=C3C(=O)N(CCCC1=O)C)C#N)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:130741

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