Cas no 1947-37-1 (Tetragastrin)

Tetragastrin structure
Tetragastrin structure
Product Name:Tetragastrin
CAS No:1947-37-1
MF:C29H36N6O6S
MW:596.697745323181
MDL:MFCD00076492
CID:146871
PubChem ID:24900382
Update Time:2025-04-19

Tetragastrin Chemical and Physical Properties

Names and Identifiers

    • Gastrin Tetrapeptide
    • Gastrin Tetrapeptide, Cholecystokinin Tetrapeptide
    • TETRAGASTRIN
    • Cholecystokinin C-terminal tetrapeptide
    • cholecystokinin tetrapeptide
    • cholecystokinin-4
    • H-Trp-Met-Asp-Phe-NH2
    • L-Phenylalaninamide,L-tryptophyl-L-methionyl-L-a-aspartyl
    • CCK-4
    • Tetragastrin hydrochloride
    • Trp-Met-Asp-Phe amide
    • Cholecystokinin fragment 30-33 amide
    • CCK-4 Acetate
    • Cholecystokinin(36-39)
    • H-Trp-Met-Asp-Phe-NH2 acetate
    • Cholecystokinin, CCK Tetrapeptide
    • 4-7-Cholecystokinin-7 (swine) (9CI)
    • CCK-4 Acetate, Gastrin Tetrapeptide
    • 4-7-Cholecystokinin-7(swine) (9CI)
    • L-tryptophyl-L-methionyl-L-aspartylphenyl-Alaninamide
    • L-Trp-L-Met-L-Asp-L-Phe-NH(2)
    • (3S)-3-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
    • SR-01000883973-1
    • Tetragastrin (JAN)
    • L-tryptophyl-L-methionyl-L-alpha-aspartyl-L-phenylalaninamide
    • L-Phenylalaninamide, L-tryptophyl-L-methionyl-L-alpha-aspartyl-
    • L-tryptophyl-L-methionyl-L-aspartyl-L-phenylalaninamide
    • HY-125556
    • CS-0092217
    • (S)-4-(((S)-1-amino-1-oxo-3-phenylpropan-2-yl)amino)-3-((S)-2-((S)-2-amino-3-(1H-indol-3-yl)propanamido)-4-(methylthio)butanamido)-4-oxobutanoic acid
    • SCHEMBL9710792
    • BDBM50024317
    • (S)-4-((S)-1-amino-1-oxo-3-phenylpropan-2-ylamino)-3-((S)-2-((S)-2-amino-3-(1H-indol-3-yl)propanamido)-4-(methylthio)butanamido)-4-oxobutanoic acid
    • WMDF-NH(2)
    • L-PHENYLALANINAMIDE, L-TRYPTOPHYL-L-METHIONYL-L-.ALPHA.-ASPARTYL-
    • SR-01000883973
    • L-Phenylalaninamide, N-((phenylmethoxy)carbonyl)-L-tryptophyl-L-methionyl-L-aspartyl-
    • 1947-37-1
    • Gastrin(14-17)(human)
    • UNII-0OL293AV80
    • (3S)-3-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-carbamoyl-2-phenylethyl]carbamoyl}propanoic acid
    • 3-{2-[2-Amino-3-(1H-indol-3-yl)-propionylamino]-4-methylsulfanyl-butyrylamino}-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid
    • Trp-Met-Asp-Phe-NH(2)
    • Gastrin tetrapeptide amide
    • D01456
    • MS-30582
    • N-((Phenylmethoxy)carbonyl)-L-tryptophyl-L-methionyl-L-aspartyl-L-phenylalaninamide
    • CCRIS 3246
    • TETRAGASTRIN [WHO-DD]
    • CHEBI:32210
    • CHEMBL120632
    • 4-7-cholecystokinin-7 (swine)
    • L-Triptophyl-L-methyionyl-L-alpha-aspartyl-L-phenylalaninamide
    • Tetragastrin [JAN]
    • DTXSID601027522
    • AKOS040744602
    • Tetragastrin (hydrochloride)
    • BRD-K70369756-001-01-3
    • CHEBI:137728
    • 0OL293AV80
    • CKK-4
    • AOC Tetragastrin
    • Cholecystokinin 4
    • CCK (30-33)
    • AOC Tetrapeptide
    • Cholecystokinin (30-33)
    • (3S)-3-((2S)-2-((2S)-2-amino-3-(1H-indol-3-yl)propanamido)-4-(methylsulfanyl)butanamido)-3-(((1S)-1-carbamoyl-2-phenylethyl)carbamoyl)propanoic acid
    • Cholecystokinin-Tetrapeptide
    • Tetrapeptide, Gastrin
    • 4, Cholecystokinin
    • AOC-Tetrapeptide
    • L-Tryptophyl-L-methionyl-L-.alpha.-aspartyl-L-phenylalaninamide
    • (3S)-3-(((2S)-2-(((2S)-2-amino-3-(1H-indol-3-yl)propanoyl)amino)-4-methylsulfanylbutanoyl)amino)-4-(((2S)-1-amino-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoic acid
    • Tetragastrin
    • MDL: MFCD00076492
    • Inchi: 1S/C29H36N6O6S/c1-42-12-11-22(33-27(39)20(30)14-18-16-32-21-10-6-5-9-19(18)21)28(40)35-24(15-25(36)37)29(41)34-23(26(31)38)13-17-7-3-2-4-8-17/h2-10,16,20,22-24,32H,11-15,30H2,1H3,(H2,31,38)(H,33,39)(H,34,41)(H,35,40)(H,36,37)/t20-,22-,23-,24-/m0/s1
    • InChI Key: RGYLYUZOGHTBRF-BIHRQFPBSA-N
    • SMILES: S(C)CC[C@@H](C(N[C@H](C(N[C@H](C(N)=O)CC1C=CC=CC=1)=O)CC(=O)O)=O)NC([C@H](CC1=CNC2C=CC=CC1=2)N)=O

Computed Properties

  • Exact Mass: 730.27800
  • Monoisotopic Mass: 596.242
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 42
  • Rotatable Bond Count: 16
  • Complexity: 948
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _2.1
  • Topological Polar Surface Area: 235A^2

Experimental Properties

  • Density: 1.341
  • Boiling Point: 1159.2°Cat760mmHg
  • Flash Point: 654.8°C
  • Refractive Index: 1.643
  • PSA: 247.11000
  • LogP: 4.67950

Tetragastrin Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Storage Condition:?20°C

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