Chemical Compound

(3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S,3E)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid

CAS Registry Number 115295-08-4
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(3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S,3E)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid 结构式
Primary record

(3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S,3E)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid

库存
4,314 克
纯度
99.2 %
CAS
115295-08-4

化合物标识与属性

CAS
115295-08-4
PubChem CID
6449837
SMILES
CCCC[C@@H](C(=O)N[C@@H](CC(=O)OS(=O)(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@@H](CC(=O)O)NC(=O)OC(C)(C)C)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@@H](CCCCN)NC[C@H](/C=C/C=C)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Canonical SMILES
C=C/C=C/[C@@H](CN[C@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)OS(=O)(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(=O)[C@@H](CC(=O)O)NC(=O)OC(C)(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1

名称与同义词

  • BC 197
  • RefChem:116770
  • AC1O6A7X
  • SCHEMBL29485012
  • BC-197
  • 115295-08-4
  • CID6449837
  • 2,4,5-Trimethyl-2H-pyrazol-3-carbonsaeure
  • Boc-asp-tyr(SO3H)-ahx-lys-trp-ahx-asp-phe-NH2
  • Boc-asp-tyr(SO3H)-nle-lys-trp-nle-asp-phe-NH2
  • (3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S,3E)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoic acid
  • Boc-aspartyl-tyrosyl(SO3H)-norelucyl-lysyl-tryptophyl-norleucyl-aspartyl-phenylalaninamide
  • (2S,5S,8R,11S,14S,17S,20S,24R)-11-((1H-indol-3-yl)methyl)-2-amino-8-(4-aminobutyl)-20-benzyl-5-((E)-buta-1,3-dien-1-yl)-24-((tert-butoxycarbonyl)amino)-14-butyl-1-(4-hydroxyphenyl)-3,9,12,15,18,21,23-heptaoxo-17-(2-oxo-2-(sulfooxy)ethyl)-4,7,10,13,16,19,22-heptaazahexacosan-26-oic acid
  • L-Phenylalaninamide, N-((1,1-dimethylethoxy)carbonyl)-D-alpha-aspartyl-O-sulfo-L-tyrosyl-L-norleucyl-D-lysyl-L-tryptophyl-L-norleucyl-L-alpha-aspartyl-, cyclic (1-4)-peptide
  • (3R)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-6-amino-2-[[(2S,3E)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexa-3,5-dienyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-oxo-4-sulfooxybutanoyl]amino]-3-phenylpropan
  • L-Phenylalaninamide, N- ((1,1-dimethylethoxy)carbonyl)-D-alpha-aspartyl-O-sulfo-L-tyrosyl-L-norleucyl-D-lysyl-L-tryptophyl-L-norleucyl-L-alpha-aspartyl-, cyclic (1-4)-peptide
  • L-Phenylalaninamide,N-[(1,1-dimethylethoxy)carbonyl]-D-a-aspartyl-O-sulfo-L-tyrosyl-L-norleucyl-D-lysyl-L-tryptophyl-L-norleucyl-L-a-aspartyl-, cyclic (1?4)-peptide