Chemical Compound

N-{(3S,6R,9S,12S)-9-(4-Aminobutyl)-3-benzyl-4,7,10,13-tetrahydroxy-12-[(1R)-1-hydroxyethyl]-6-[(1H-indol-3-yl)methyl]-1-[(2S)-pyrrolidin-2-yl]-2-thia-5,8,11-triazatrideca-4,7,10-trien-13-ylidene}-L-phenylalanine

CAS Registry Number 90550-57-5
N-{(3S,6R,9S,12S)-9-(4-Aminobutyl)-3-benzyl-4,7,10,13-tetrahydroxy-12-[(1R)-1-hydroxyethyl]-6-[(1H-indol-3-yl)methyl]-1-[(2S)-pyrrolidin-2-yl]-2-thia-5,8,11-triazatrideca-4,7,10-trien-13-ylidene}-L-phenylalanine 结构式
Primary record

N-{(3S,6R,9S,12S)-9-(4-Aminobutyl)-3-benzyl-4,7,10,13-tetrahydroxy-12-[(1R)-1-hydroxyethyl]-6-[(1H-indol-3-yl)methyl]-1-[(2S)-pyrrolidin-2-yl]-2-thia-5,8,11-triazatrideca-4,7,10-trien-13-ylidene}-L-phenylalanine

库存
5,258 克
纯度
99.1 %
CAS
90550-57-5

化合物标识与属性

CAS
90550-57-5
PubChem CID
56843845
SMILES
C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CC4=CC=CC=C4)SC[C@@H]5CCCN5)O
Canonical SMILES
C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)SC[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

名称与同义词

  • Cyclo-P-TM-ptltp
  • RefChem:129307
  • Cyclo(pro-CH2S-phe-trp-lys-thr-phe)
  • DTXSID10920326
  • Cyclo(prolyl-thiomethyl-phenylalanyl-tryptophyl-lysyl-threonyl-phenylalanyl)
  • 90550-57-5
  • L-Phenylalanine, N-(1-oxo-3-phenyl-2-((2-pyrrolidinylmethyl)thio)propyl)-D-tryptophyl-L-lysyl-L-threonyl-, (S-(R*,R*))-
  • N-[9-(4-Aminobutyl)-3-benzyl-4,7,10,13-tetrahydroxy-12-(1-hydroxyethyl)-6-[(1H-indol-3-yl)methyl]-1-(pyrrolidin-2-yl)-2-thia-5,8,11-triazatrideca-4,7,10-trien-13-ylidene]phenylalanine
  • N-{(3S,6R,9S,12S)-9-(4-Aminobutyl)-3-benzyl-4,7,10,13-tetrahydroxy-12-[(1R)-1-hydroxyethyl]-6-[(1H-indol-3-yl)methyl]-1-[(2S)-pyrrolidin-2-yl]-2-thia-5,8,11-triazatrideca-4,7,10-trien-13-ylidene}-L-phenylalanine