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

Concept information

Preferred term

LSM 14094  

Type

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

Broader concept

charge

  • 0

formula

  • C25H29F3N4O3

inchi

  • InChI=1S/C25H29F3N4O3/c26-25(27,28)8-13-31-20-14-32-19(5-4-17(23(32)34)16-6-9-29-10-7-16)22(31)21(18(20)15-33)24(35)30-11-2-1-3-12-30/h4-7,9-10,18,20-22,33H,1-3,8,11-15H2/t18-,20-,21+,22+/m1/s1

inchikey

  • DKHQAGHBVQSALK-YJMBLLCNSA-N

mass

  • 490.519

monoisotopicmass

  • 490.21918

smiles

  • C1CCN(CC1)C(=O)[C@H]2[C@@H]([C@H]3CN4C(=CC=C(C4=O)C5=CC=NC=C5)[C@@H]2N3CCC(F)(F)F)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:102748

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