1702967-37-0

Name PSMA-617
CAS 1702967-37-0
Molecular Formula C49H71N9O16
MDL Number MFCD31715458
Molecular Weight 1042.14
MOL File 1702967-37-0.mol

Chemical Properties

Boiling point  1371.9±65.0 °C(Predicted)
density  1.322±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  Water:150.0(Max Conc. mg/mL);100.13(Max Conc. mM)
DMSO:125.0(Max Conc. mg/mL);83.43(Max Conc. mM)
form  Solid
pka 1.83±0.10(Predicted)
color  White to off-white
InChIKey JBHPLHATEXGMQR-LFWIOBPJSA-N
SMILES C(O)(=O)[C@H](CCCCNC(=O)[C@H](CC1=CC=C2C(=C1)C=CC=C2)NC([C@@H]1CC[C@@H](CNC(CN2CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC2)=O)CC1)=O)NC(N[C@H](C(O)=O)CCC(O)=O)=O

Hazard Information

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