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SENNIDINE B

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Category Hepatitis C Virus (HCV)
CAS 517-44-2
Description Purgative activity.
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Product Information

Synonyms SENNIDINE B; (R*,S*)-9,9',10,10'-tetrahydro-4,4',5,5'-tetrahydroxy-10,10'-dioxo[9,9'-bianthracene]-2,2'-dicarboxylic acid; 9-(2-carboxy-4,5-dihydroxy-10-oxo-9H-anthracen-9-yl)-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid; Sennidin B; SENNIDINE B hplc; 9-(2-carboxy-4,5-dihydroxy-10-keto-9H-anthracen-9-yl)-4,5-dihydroxy-10-keto-9H-anthracene-2-carboxylic acid
IUPAC Name (9S)-9-[(9R)-2-carboxy-4,5-dihydroxy-10-oxo-9H-anthracen-9-yl]-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid
Molecular Weight 538.46
Molecular Formula C30H18O10
Canonical SMILES C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O
InChI InChI=1S/C30H18O10/c31-17-5-1-3-13-21(15-7-11(29(37)38)9-19(33)25(15)27(35)23(13)17)22-14-4-2-6-18(32)24(14)28(36)26-16(22)8-12(30(39)40)10-20(26)34/h1-10,21-22,31-34H,(H,37,38)(H,39,40)/t21-,22+
InChIKey JPMRHWLJLNKRTJ-SZPZYZBQSA-N
Boiling Point 801.8±65.0 °C at 760 mmHg
Flash Point 452.6±30.8 °C
Purity >98%
Density 1.7±0.1 g/cm3
Solubility In vitro:
10 mM in DMSO
Appearance Yellow powder
Application Purgative
Storage 4°C, protect from light
* In solvent :
-80°C, 6 months
-20°C, 1 month (protect from light)
Complexity 977
Exact Mass 538.08999677
Index Of Refraction 1.806
PSA 189.66000
Target HCV; Akt; GLUT
Vapor Pressure 0.0±3.0 mmHg at 25°C
XLogP3-AA 4.8

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