40980-51-6

Name pseudomonic acid I
CAS 40980-51-6
Molecular Formula C26H44O10
Molecular Weight 516.62
MOL File 40980-51-6.mol
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Chemical Properties

Boiling point  689.4±55.0 °C(Predicted)
density  1.234±0.06 g/cm3(Predicted)
pka 4.78±0.10(Predicted)
InChIKey JGKQAKOVZJHZTF-QSYBISIHNA-N
SMILES [C@@H]1(C[C@@]2(O)CO[C@@H](C/C(/C)=C/C(=O)OCCCCCCCCC(=O)O)[C@H](O)[C@@H]2O)O[C@@]1([H])[C@@H](C)[C@@H](O)C |&1:0,2,6,25,27,30,32,34,r|

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