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

Concept information

Preferred term

LSM 42548  

Type

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

charge

  • 0

formula

  • C29H35N3O5

inchi

  • InChI=1S/C29H35N3O5/c1-31-15-14-23-12-13-25(35-3)26(37-23)19-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26+/m0/s1

inchikey

  • PPQNLGLVWDESKN-BKJQLSFMSA-N

mass

  • 505.606

monoisotopicmass

  • 505.25767

smiles

  • CN1CC[C@H]2CC[C@H]([C@H](O2)COC3=C(C=CC=C3C(=O)N(C[C@H](CC1=O)C4=CC=CC=C4)C)C#N)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:131000

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