7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid

Modify Date: 2025-08-29 18:42:16

7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid Structure
7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid structure
 Common Name 7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid
CAS Number 78512-63-7 Molecular Weight 628.75800
Density 1.194g/cm3 Boiling Point 1048.6ºC at 760 mmHg
Molecular Formula C29H52N6O9 Melting Point N/A
MSDS N/A Flash Point 587.9ºC

 Names

Name 7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid

 Chemical & Physical Properties

Density 1.194g/cm3
Boiling Point 1048.6ºC at 760 mmHg
Molecular Formula C29H52N6O9
Molecular Weight 628.75800
Flash Point 587.9ºC
Exact Mass 628.38000
PSA 260.11000
LogP 3.39430
Index of Refraction 1.523
InChIKey BGGBQBAMDUCKFN-ZGJBTBESSA-N
SMILES CCCCCCCCCCCC(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(NC(=O)CN)C(N)=O)C(=O)O)C(=O)O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OL5400000
CHEMICAL NAME :
DL-Lysinamide, glycyl-6-carboxy-N(sup 6)-(N-(N-(1-oxododecyl)-L-alanyl)-D-gamma-glutamyl)-, (R*,R*)-
CAS REGISTRY NUMBER :
78512-63-7
LAST UPDATED :
199406
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C29-H52-N6-O9
MOLECULAR WEIGHT :
628.87

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
410 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 9,763,1984
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Chemsrc provides CAS#:78512-63-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid>> amp version: 7-amino-6-[(2-aminoacetyl)amino]-2-[[4-carboxy-4-[2-(dodecanoylamino)propanoylamino]butanoyl]amino]-7-oxoheptanoic acid

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