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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > pentagastrin

Preferred term

pentagastrin  

Type

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

Broader concept

charge

  • 0

formula

  • C37H49N7O9S

inchi

  • InChI=1S/C37H49N7O9S/c1-37(2,3)53-36(52)39-16-14-30(45)41-28(19-23-21-40-25-13-9-8-12-24(23)25)34(50)42-26(15-17-54-4)33(49)44-29(20-31(46)47)35(51)43-27(32(38)48)18-22-10-6-5-7-11-22/h5-13,21,26-29,40H,14-20H2,1-4H3,(H2,38,48)(H,39,52)(H,41,45)(H,42,50)(H,43,51)(H,44,49)(H,46,47)/t26-,27-,28-,29-/m0/s1

inchikey

  • NEYNJQRKHLUJRU-DZUOILHNSA-N

mass

  • 767.894

monoisotopicmass

  • 767.33125

smiles

  • C(N[C@@H](CC1=CNC2=C1C=CC=C2)C(N[C@@H](CCSC)C(N[C@@H](CC(O)=O)C(N[C@@H](CC3=CC=CC=C3)C(N)=O)=O)=O)=O)(=O)CCNC(=O)OC(C)(C)C

subset

  • 2_STAR

synonym EXACT

  • Pentagastrin

synonym RELATED

  • ICI 50123
  • pentavlon
  • peptavlon

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31974

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