76996-27-5

Name garcinone C
CAS 76996-27-5
Molecular Formula C23H26O7
MDL Number MFCD11111285
Molecular Weight 414.45
MOL File 76996-27-5.mol
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Chemical Properties

Boiling point  689.0±55.0 °C(Predicted)
density  1.367
storage temp.  4°C, protect from light
solubility  ≥ 80mg/mL in DMSO
form  Solid
pka 7.13±0.20(Predicted)
color  Light yellow to yellow
InChI 1S/C23H26O7/c1-11(2)5-6-12-14(24)9-17-19(21(12)27)22(28)18-13(7-8-23(3,4)29)20(26)15(25)10-16(18)30-17/h5,9-10,24-27,29H,6-8H2,1-4H3
InChIKey HLOCLVMUASBDDP-UHFFFAOYSA-N
SMILES OC1=C(CCC(C)(O)C)C2=C(C=C1O)OC3=CC(O)=C(CC=C(C)C)C(O)=C3C2=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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