Chem
J-GLOBAL ID：200907082586979309   Nikkaji number：J2.665.733D

ZP-123

ロチガプチド
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： C28H39N7O9
Molecular formula furigana： C28-H39-N7-O9
Molecular weight： 617.660
InChI： InChI=1S/C28H39N7O9/c1-15(25(41)30-12-23(29)39)32-24(40)13-31-26(42)22-11-19(38)14-35(22)28(44)21-4-3-9-34(21)27(43)20(33-16(2)36)10-17-5-7-18(37)8-6-17/h5-8,15,19-22,37-38H,3-4,9-14H2,1-2H3,(H2,29,39)(H,30,41)(H,31,42)(H,32,40)(H,33,36)/t15-,19+,20-,21-,22-/m1/s1
InChI key： GFJRASPBQLDRRY-TWTQBQJDSA-N
SMILES： C[C@@H](NC(=O)CNC(=O)[C@H]1C[C@H](O)CN1C(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C)C(=O)NCC(=O)N
Systematic name  (3)：
  • N-Ac-D-Tyr-D-Pro-[(4S)-4-ヒドロキシ-D-Pro-]-Gly-D-Ala-Gly-NH2
  • (2R)-N-(カルバモイルメチル)-2-(2-{[(2R,4S)-1-[(2R)-1-[(2R)-2-アセトアミド-3-(4-ヒドロキシフェニル)プロパノイル]ピロリジン-2-カルボニル]-4-ヒドロキシピロリジン-2-イル]ホルムアミド}アセトアミド)プロパンアミド
  • (2R)-N-(carbamoylmethyl)-2-(2-{[(2R,4S)-1-[(2R)-1-[(2R)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]-4-hydroxypyrrolidin-2-yl]formamido}acetamido)propanamide
Other name (5)：
  • N-Ac-D-Tyr-D-Pro-[(4S)-4-Hydroxy-D-Pro-]-Gly-D-Ala-Gly-NH2
  • ロチガプチド
  • ZP-123
  • Rotigaptide
  • GAP-484
CAS registry number： 355151-12-1
KEGG DRUG： D05767
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