Chemical Compound

(2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamido-4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]butanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide

CAS Registry Number 161238-74-0
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(2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamido-4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]butanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide 结构式
Primary record

(2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamido-4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]butanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide

库存
2,108 克
纯度
98.2 %
CAS
161238-74-0

化合物标识与属性

CAS
161238-74-0
PubChem CID
3083490
SMILES
CCCC[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]2CCCN2C(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](C)NC(=O)[C@H](CCNC6=CC=C(C7=NON=C67)[N+](=O)[O-])NC(=O)C8=CC=CC=C8
Canonical SMILES
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCNc1ccc([N+](=O)[O-])c2nonc12)NC(=O)c1ccccc1)C(N)=O

名称与同义词

  • Bz-Dab(nbd)-awfpp-nle-NH2
  • AC1MJ0PV
  • RefChem:917783
  • Bz-Dab(nbd)-ala-trp-phe-pro-pro-nle-NH2
  • DTXSID10167092
  • orb1702462
  • DTXCID8089583
  • 161238-74-0
  • VOHGFGFPNNJOFE-GYCURRFDSA-N
  • HY-P2603
  • C56H65N13O11
  • AKOS040746661
  • CID3083490
  • C56-H65-N13-O11
  • J598.791A
  • (2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamido-4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]butanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
  • Nalpha-Benzoyl-dab(gamma-nbd)-ala-D-trp-phe-D-pro-pro-nle-NH2
  • N-alpha-Benzoyl-(gamma-(7-nitrobenz-2-oxa-1,3-diazol-4-yl)-2,4-diaminobutyryl)-alanyl-tryptophyl-phenylalanyl-prolyl-prolyl-norleucinamide
  • (2S)-2-{[(2S)-1-[(2R)-1-[(2S)-2-[(2R)-3-(1H-indol-3-yl)-2-[(2S)-2-[(2S)-4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-2-(phenylformamido)butanamido]propanamido]propanamido]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]formamido}hexanamide
  • (2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamido-4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]butanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-
  • (S)-N-((S)-1-amino-1-oxohexan-2-yl)-1-(((S)-2-benzamido-4-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)butanoyl)-L-alanyl-D-tryptophyl-L-phenylalanyl-D-prolyl)pyrrolidine-2-carboxamide
  • Bz-N4-(7-Nitro-2,1,3-benzoxadiazol-4-yl)-L-A2bu-L-Ala-D-Trp-L-Phe-D-Pro-L-Pro-L-Nle-NH2
  • L-Norleucinamide, N2-benzoyl-N4-(7-nitro-2,1,3-benzoxadiazol-4-yl)-L-2,4-diaminobutanoyl-L-alanyl-D-tryptophyl-L-phenylalanyl-D-prolyl-L-prolyl-
  • N-{(2S)-2-Benzamido-4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]butanoyl}-L-alanyl-D-tryptophyl-L-phenylalanyl-D-prolyl-L-prolyl-L-norleucinamide