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Berberine Sulfate Trihydrate
[CAS# 6190-33-6]

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Identification
Name Berberine Sulfate Trihydrate
Synonyms Berberine Sulfate (2:1); Berberine Sulfate Trihydrate; Berbinium, 7,8,13,13A-Tetradehydro-9,10-Dimethoxy-2,3-(Methylenedioxy)-, Sulfate, Trihydrate
Molecular Structure CAS#: 6190-33-6, Berberine Sulfate Trihydrate
Molecular Formula C40H36N2O12S
Molecular Weight 768.79
CAS Registry Number 6190-33-6
SMILES [N+]25=C(C1=CC3=C(C=C1CC2)OCO3)C=C4C=CC(=C(C4=C5)OC)OC.C7=C6C=CC(=C(C6=C[N+]9=C7C8=CC%10=C(C=C8CC9)OCO%10)OC)OC.O=[S](=O)([O-])[O-]
InChI 1S/2C20H18NO4.H2O4S/c2*1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;1-5(2,3)4/h2*3-4,7-10H,5-6,11H2,1-2H3;(H2,1,2,3,4)/q2*+1;/p-2
InChIKey OJVABJMSSDUECT-UHFFFAOYSA-L
References
(1) Lin Huang, Xiuli Chen, Thanh Xuan Nguyen, Huiru Tang, Liming Zhang and Guang Yang. Nano-cellulose 3D-networks as controlled-release drug carriers, J. Mater. Chem. B, 2013, 1, 2976.
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