Chem
J-GLOBAL ID：200907081002151227   Nikkaji number：J1.024C

Lypressin

リプレシン
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： C46H65N13O12S2
Molecular formula furigana： C46-H65-N13-O12-S2
Molecular weight： 1056.230
InChI： InChI=1S/C46H65N13O12S2/c47-17-5-4-9-29(40(65)52-22-38(51)63)54-45(70)35-10-6-18-59(35)46(71)34-24-73-72-23-28(48)39(64)55-31(20-26-11-13-27(60)14-12-26)43(68)56-32(19-25-7-2-1-3-8-25)42(67)53-30(15-16-36(49)61)41(66)57-33(21-37(50)62)44(69)58-34/h1-3,7-8,11-14,28-35,60H,4-6,9-10,15-24,47-48H2,(H2,49,61)(H2,50,62)(H2,51,63)(H,52,65)(H,53,67)(H,54,70)(H,55,64)(H,56,68)(H,57,66)(H,58,69)/t28-,29-,30-,31?,32-,33?,34?,35-/m0/s1
InChI key： BJFIDCADFRDPIO-KKSWSVFASA-N
SMILES： NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)C1CSSC[C@H](N)C(=O)NC(Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)N)C(=O)NC(CC(=O)N)C(=O)N1)C(=O)NCC(=O)N
Systematic name  (4)：
  • L-Cys(1)-L-Tyr-L-Phe-L-Gln-L-Asn-L-Cys(1)-L-Pro-L-Lys-Gly-NH2
  • L-Cys(1)-L-Tyr-L-Phe-L-Glu(NH2)-L-Asp(NH2)-L-Cys(1)-L-Pro-L-Lys-Gly-NH2
  • (2S)-6-アミノ-2-{[(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-アミノ-13-ベンジル-10-(2-カルバモイルエチル)-7-(カルバモイルメチル)-16-[(4-ヒドロキシフェニル)メチル]-6,9,12,15,18-ペンタオキソ-1,2-ジチア-5,8,11,14,17-ペンタアザシクロイコサン-4-カルボニル]ピロリジン-2-イル]ホルムアミド}-N-(カルバモイルメチル)ヘキサンアミド
  • (2S)-6-amino-2-{[(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-13-benzyl-10-(2-carbamoylethyl)-7-(carbamoylmethyl)-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl]pyrrolidin-2-yl]formamido}-N-(carbamoylmethyl)hexanamide
Other name (9)：
  • リシンバソプレッシン
  • Lysine vasopressin
  • 8-Lys-Vasopressin
  • リプレシン
  • [Lys8]バソプレッシン
Show all
CAS registry number： 50-57-7
Regulation number (2)：
  • EINECS2000505
  • YW8659000
KEGG DRUG： D00366
KEGG COMPOUND： C07105
Application (3)：
vasoconstrictor ,  hemostatic ,  urologic active drug
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