Chemical Compound

Decorinyl

CAS Registry Number960531-53-7
Decorinyl chemical structure
Primary record

Decorinyl

CAS
960531-53-7
PubChem CID
90479646
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)N
Molecular Formula
C22H42N8O7
Molecular Weight
530.627
Exact Mass
530.3176
InChI
InChI=1S/C22H42N8O7/c1-3-12(2)17(21(36)28-14(18(25)33)8-6-10-27-22(26)37)30-20(35)15(11-16(31)32)29-19(34)13(24)7-4-5-9-23/h12-15,17H,3-11,23-24H2,1-2H3,(H2,25,33)(H,28,36)(H,29,34)(H,30,35)(H,31,32)(H3,26,27,37)/t12-,13-,14-,15-,17-/m0/s1
InChIKey
GKPMARPRXONRJX-BWJWTDLKSA-N
LogP
-2.6483
TPSA
274.85

Names and synonyms

  • Decorinyl
  • Tripeptide-10 citrulline
  • UNII-2732R0E76W
  • RefChem:203373
  • Trippetide-10 Citrulline
  • Tripeptide-10 citrulline [INCI]
  • 2732R0E76W
  • orb1943819
  • 960531-53-7
  • SCHEMBL29392308
  • GKPMARPRXONRJX-BWJWTDLKSA-N
  • HY-P5242
  • BAT-016700
  • CS-0863844
  • L-Ornithinamide, L-lysyl-L-alpha-aspartyl-L-isoleucyl-N5-(aminocarbonyl)-
  • L-Lysyl-L-alpha-aspartyl-L-isoleucyl-L-citrullinamide
  • Q27254158
  • L-ORNITHINAMIDE, L-LYSYL-L-.ALPHA.-ASPARTYL-L-ISOLEUCYL-N5-(AMINOCARBONYL)-
  • (3S)-4-[[(2S,3S)-1-[[(2S)-1-amino-5-(carbamoylamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-[[(2S)-2,6-diaminohexanoyl]amino]-4-oxobutanoic acid
  • (S)-4-(((2S,3S)-1-(((S)-1-amino-1-oxo-5-ureidopentan-2-yl)amino)-3-methyl-1-oxopentan-2-yl)amino)-3-((S)-2,6-diaminohexanamido)-4-oxobutanoic acid