Chem
J-GLOBAL ID：200907040196198786   Nikkaji number：J1.654.156G

Phepropeptin C

フェプロペプチンC
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： C38H60N6O6
Molecular formula furigana： C38-H60-N6-O6
Molecular weight： 696.934
InChI： InChI=1S/C38H60N6O6/c1-9-25(8)32-37(49)41-28(19-23(4)5)34(46)42-30(21-26-14-11-10-12-15-26)38(50)44-17-13-16-31(44)36(48)40-27(18-22(2)3)33(45)39-29(20-24(6)7)35(47)43-32/h10-12,14-15,22-25,27-32H,9,13,16-21H2,1-8H3,(H,39,45)(H,40,48)(H,41,49)(H,42,46)(H,43,47)/t25-,27-,28-,29+,30+,31-,32-/m0/s1
InChI key： AKQUYKYHJPCGHJ-CMKNBVMOSA-N
SMILES： CC[C@H](C)[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC1=O
Systematic name  (3)：
  • シクロ(L-Leu-D-Phe-L-Pro-L-Leu-D-Leu-L-Ile-)
  • (3S,6R,9S,12S,15R,20aS)-15-ベンジル-9-[(2S)-ブタン-2-イル]-3,6,12-トリス(2-メチルプロピル)-イコサヒドロピロロ[1,2-a]1,4,7,10,13,16-ヘキサアザシクロオクタデカン-1,4,7,10,13,16-ヘキサオン
  • (3S,6R,9S,12S,15R,20aS)-15-benzyl-9-[(2S)-butan-2-yl]-3,6,12-tris(2-methylpropyl)-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecane-1,4,7,10,13,16-hexone
Other name (3)：
  • Cyclo(L-Leu-D-Phe-L-Pro-L-Leu-D-Leu-L-Ile-)
  • フェプロペプチンC
  • Phepropeptin C
Thsaurus map：
Thesaurus Map

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