Chem
J-GLOBAL ID：200907016316543107   Nikkaji number：J345.752D

DiMe-C7

DiMe-C7
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C43H61N9O9S
Molecular formula furigana： C43-H61-N9-O9-S
Molecular weight： 880.080
InChI： InChI=1S/C43H61N9O9S/c1-26(2)22-32(41(59)48-29(38(45)56)20-21-62-5)47-37(55)25-51(3)43(61)34(24-28-14-10-7-11-15-28)52(4)42(60)33(23-27-12-8-6-9-13-27)50-40(58)31(16-18-35(44)53)49-39(57)30-17-19-36(54)46-30/h6-15,26,29-34H,16-25H2,1-5H3,(H2,44,53)(H2,45,56)(H,46,54)(H,47,55)(H,48,59)(H,49,57)(H,50,58)/t29-,30-,31-,32-,33-,34-/m0/s1
InChI key： IEEBRBMEXFNVKU-CVUOCSEZSA-N
SMILES： CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N
Systematic name  (4)：
  • 5-オキソ-L-Pro-L-Gln-L-Phe-N-メチル-L-Phe-N-メチル-Gly-L-Leu-L-Met-NH2
  • pGlu-L-Glu(NH2)-L-Phe-N-メチル-L-Phe-Sar-L-Leu-L-Met-NH2
  • (2S)-N-[(1S)-1-{[(1S)-1-[({[(1S)-1-{[(1S)-1-カルバモイル-3-(メチルスルファニル)プロピル]カルバモイル}-3-メチルブチル]カルバモイル}メチル)(メチル)カルバモイル]-2-フェニルエチル](メチル)カルバモイル}-2-フェニルエチル]-2-{[(2S)-5-オキソピロリジン-2-イル]ホルムアミド}ペンタンジアミド
  • (2S)-N-[(1S)-1-{[(1S)-1-[({[(1S)-1-{[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]carbamoyl}-3-methylbutyl]carbamoyl}methyl)(methyl)carbamoyl]-2-phenylethyl](methyl)carbamoyl}-2-phenylethyl]-2-{[(2S)-5-oxopyrrolidin-2-yl]formamido}pentanediamide
Other name (6)：
  • [pGlu5,MePhe8,Sar9]サブスタンスP(5-11)
  • [pGlu5,MePhe8,Sar9]substance P(5-11)
  • [pGlu5,MePhe8,Sar9]物質P(5-11)
  • DiMe-C7
  • pGlu-L-Glu(NH2)-L-Phe-N-Methyl-L-Phe-Sar-L-Leu-L-Met-NH2
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CAS registry number： 77128-69-9
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