skip to main content

Chemistry, part 1

Content language

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

Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > peptide anion > beta-casochemotide-1(1-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > peptide anion > beta-casochemotide-1(1-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > peptide anion > beta-casochemotide-1(1-)

Preferred term

beta-casochemotide-1(1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C29H40N5O9

inchi

  • InChI=1S/C29H41N5O9/c1-16(2)24(26(39)31-20(11-12-23(36)37)28(41)34-14-4-6-22(34)29(42)43)32-25(38)21-5-3-13-33(21)27(40)19(30)15-17-7-9-18(35)10-8-17/h7-10,16,19-22,24,35H,3-6,11-15,30H2,1-2H3,(H,31,39)(H,32,38)(H,36,37)(H,42,43)/p-1/t19-,20-,21-,22-,24-/m0/s1

inchikey

  • WRNQQFNBEUKAAX-YGQNSOCVSA-M

is_conjugate_base_of

mass

  • 602.666

monoisotopicmass

  • 602.28315

smiles

  • N1([C@@H](CCC1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)[O-])C(N2[C@@H](CCC2)C(=O)[O-])=O)C(C)C)C([C@H](CC3=CC=C(C=C3)O)[NH3+])=O

subset

  • 3_STAR

synonym EXACT

  • 1-[(2S)-2-azaniumyl-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-({(2S)-4-carboxylato-1-[(2S)-2-carboxylatopyrrolidin-1-yl]-1-oxobutan-2-yl}amino)-3-methyl-1-oxobutan-2-yl]-L-prolinamide

synonym RELATED

  • L-Tyr-L-Pro-L-Val-L-Glu-L-Pro(1-)
  • L-tyrosyl-L-prolyl-L-valyl-L-alpha-glutamyl-L-proline(1-)
  • neocasomorphin-(1-5)
  • Tyr-Pro-Val-Glu-Pro(1-)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:147418

Download this concept:

RDF/XML TURTLE JSON-LD