78285-90-2

Name ECHINOCYSTIC ACID-3-GLUCOSIDE
CAS 78285-90-2
EINECS(EC#) 278-887-0
Molecular Formula C36H58O9
MDL Number MFCD00017386
Molecular Weight 634.84
MOL File 78285-90-2.mol
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Chemical Properties

Melting point  237～238℃
Boiling point  752.6±60.0 °C(Predicted)
density  1.27±0.1 g/cm3 (20 ºC 760 Torr)
storage temp.  2-8°C
solubility  Soluble in methan
form  neat
pka 4.42±0.70(Predicted)
color  White
BRN  1613820
InChIKey WYDPEADEZMZKNM-ZBKPBKBGSA-N
SMILES CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
LogP 5.610 (est)

Safety Data

WGK Germany  3
HS Code  29389090
Storage Class 13 - Non Combustible Solids

Hazard Information

Spectrum Detail

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