Chemical Compound

(2S)-6-amino-2-[[(2R)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-[[2-[2-[(2S,5S,8S,11R,14S,17S)-14-(4-aminobutyl)-5-benzyl-8-[(4-hydroxyphenyl)methyl]-11-(1H-indol-3-ylmethyl)-4-methyl-3,6,9,12,15,18-hexaoxo-17-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadec-2-yl]ethylsulfanyl]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]hexanamide

CAS Registry Number 161982-62-3
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(2S)-6-amino-2-[[(2R)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-[[2-[2-[(2S,5S,8S,11R,14S,17S)-14-(4-aminobutyl)-5-benzyl-8-[(4-hydroxyphenyl)methyl]-11-(1H-indol-3-ylmethyl)-4-methyl-3,6,9,12,15,18-hexaoxo-17-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadec-2-yl]ethylsulfanyl]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]hexanamide 结构式
Primary record

(2S)-6-amino-2-[[(2R)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-[[2-[2-[(2S,5S,8S,11R,14S,17S)-14-(4-aminobutyl)-5-benzyl-8-[(4-hydroxyphenyl)methyl]-11-(1H-indol-3-ylmethyl)-4-methyl-3,6,9,12,15,18-hexaoxo-17-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadec-2-yl]ethylsulfanyl]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]hexanamide

库存
3,139 克
纯度
98.7 %
CAS
161982-62-3

化合物标识与属性

CAS
161982-62-3
PubChem CID
9898619
SMILES
CC(C)[C@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)CC5=CC=CC=C5)C)CCSCC(=O)NC[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N)N
Canonical SMILES
CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CCSCC(=O)NC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(N)=O)NC1=O

名称与同义词

  • Depreotide
  • Depreotida
  • NeoTec
  • depreotidum
  • NeoSpect
  • Depreotide [USAN]
  • Depreotide [USAN:INN]
  • DEPREOTIDE [MI]
  • DEPREOTIDE [INN]
  • P829 cpd
  • Depreotide (USAN/INN)
  • DEPREOTIDE [WHO-DD]
  • RefChem:585764
  • NDP0H8E844
  • UNII-NDP0H8E844
  • 161982-62-3
  • SCHEMBL456503
  • Technetium Tc 99m Depreotide
  • UNII-9M48M2SF02
  • DTXSID301026951
  • CHEMBL1908335
  • SCHEMBL29399302
  • V09IA05
  • CHEBI:135908
  • DTXCID201511145
  • P829
  • P-829
  • C65H96N16O12S2
  • BAT-010032
  • CID9898619
  • DB11628
  • CID 9898619
  • P 829
  • DA-62779
  • C65-H96-N16-O12-S2
  • HY-114133
  • CS-0069943
  • NS00126788
  • D03687
  • A938537
  • Q27284812
  • (2S)-6-amino-2-[[(2R)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-[[2-[2-[(2S,5S,8S,11R,14S,17S)-14-(4-aminobutyl)-5-benzyl-8-[(4-hydroxyphenyl)methyl]-11-(1H-indol-3-ylmethyl)-4-methyl-3,6,9,12,15,18-hexaoxo-17-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadec-2-yl]ethylsulfanyl]acetyl]amino]propanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]hexanamide
  • Lys-Cys-Lys-(beta-DAP)-CH2CO-S-cyclo(hCys-(N-Me)Phe-Tyr-Trp-Lys-Val)
  • 7,7,8,8,9,9,10,10,11,11,12,12,12-tridecafluoro-dodecan-1-ol
  • CYCLO(L-HOMOCYSTEINYL-N-METHYL-L-PHENYLALANYL-L-TYROSYL-D-TRYPTOPHYL-L-LYSYL-L-VALYL) (1->1')-SULFIDE WITH 3-((MERCAPTOACETYL)AMINO)-L-ALANYL-L-LYSYL-L-CYSTEINYL-L-LYSINAMIDE
  • CYCLO(L-HOMOCYSTEINYL-N-METHYL-L-PHENYLALANYL-L-TYROSYL-D-TRYPTOPHYL-L-LYSYL-L-VALYL) (1->1')-SULPHIDE WITH 3-((MERCAPTOACETYL)AMINO)-L-ALANYL-L-LYSYL-L-CYSTEINYL-L-LYSINAMIDE
  • CYCLO(L-HOMOCYSTEINYL-N-METHYL-L-PHENYLALANYL-L-TYROSYL-D-TRYPTOPHYL-L-LYSYL-L-VALYL), (1->1')-SULFIDE WITH 3-(2-MERCAPTOACETAMIDO)-L-ALANYL-L-LYSYL-L-CYSTEINYL-L-LYSINAMIDE
  • CYCLO(L-HOMOCYSTEINYL-N-METHYL-L-PHENYLALANYL-L-TYROSYL-D-TRYPTOPHYL-L-LYSYL-L-VALYL), (1->1')-SULPHIDE WITH 3-(2-MERCAPTOACETAMIDO)-L-ALANYL-L-LYSYL-L-CYSTEINYL-L-LYSINAMIDE
  • Cyclo(L-homocysteinyl-N-methyl-L-phenylalanyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl), (1-1')-sulfide with 3-(2-mercaptoacetamido)-L-alanyl-L-lysyl-L-cysteinyl-L-lysinamide
  • Cyclo(L-homocysteinyl-N-methyl-L-phenylalanyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl), (1-1')-thioether with 3-((mercaptoacetyl)amino)-L-alanyl-L-lysyl-L-cysteinyl-L-lysinamide
  • cyclo-(N-Me)Phe-Tyr-(D-Trp)-Lys-Val-Hcy(CH2CO-(beta-Dap)-Lys-Cys-Lys-NH2)
  • (2S)-6-amino-2-(((2R)-2-(((2S)-6-amino-2-(((2S)-2-amino-3-((2-(2-((2S,5S,8S,11R,14S,17S)-14-(4-aminobutyl)-5-benzyl-8-((4-hydroxyphenyl)methyl)-11-(1H-indol-3-ylmethyl)-4-methyl-3,6,9,12,15,18-hexaoxo-17-propan-2-yl-1,4,7,10,13,16-hexazacyclooctadec-2-yl)ethylsulfanyl)acetyl)amino)propanoyl)amino)hexanoyl)amino)-3-sulfanylpropanoyl)amino)hexanamide
  • Cyclo(L-homocysteinyl-N-methyl-L-phenylalanyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-valyl) (1-1')-sulfide with 3-((mercaptoacetyl)amino)-L-alanyl-L-lysyl-L-cysteinyl-L-lysinamide
  • Lysyl-cysteinyl-lysyl-(beta-DAP) cyclo(homocysteinyl-(N-methyl)phenylalanyl-tyrosyl-tryptophyl-lysyl-valyl)thiomethyl ketone