69-25-0

Name Eledoisin
CAS 69-25-0
EINECS(EC#) 251-228-4
Molecular Formula C54H85N13O15S
MDL Number MFCD00076373
Molecular Weight 1188.4
MOL File 69-25-0.mol
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Chemical Properties

Melting point  230 °C (decomp)
Boiling point  1618.1±65.0 °C(Predicted)
density  1.289±0.06 g/cm3(Predicted)
storage temp.  −20°C
solubility  DMF: 15 mg/ml; DMSO: 20 mg/ml; DMSO:PBS (pH 7.2) (1:20): 0.04 mg/ml
form  A crystalline solid
pka 4.19±0.10(Predicted)
color  White to off-white
Optical Rotation -4422 (95% Acetic Acid)
Sequence {Glp}-Pro-Ser-Lys-Asp-Ala-Phe-Ile-Gly-Leu-Met-NH2
InChIKey AYLPVIWBPZMVSH-UHFFFAOYSA-N
SMILES C(C1NC(=O)CC1)(N1CCCC1C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)NC(CC(O)=O)C(=O)NC(C)C(=O)NC(C(=O)NC(C(C)CC)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C(=O)N)CCSC)CC1C=CC=CC=1)=O

Safety Data

WGK Germany  3
RTECS  JX8688000
HS Code  3504009000

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