Andrographidine E
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Andrographidine E
structure -
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CAS No:
113963-41-0
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Formula:
C24H26O11
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Chemical Name:
Andrographidine E
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Synonyms:
Andrographidine E;5-(beta-D-Glucopyranosyloxy)-7,8-dimethoxy-2-(2-methoxyphenyl)-4H-1-benzopyran-4-one
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CAS No:
Characteristics
157.28000
0.22
1.449±0.06 g/cm3(Predicted)
126-130 °C(Solv: methanol (67-56-1))
779.5±60.0 °C(Predicted)
267.4±26.4 °C
1.627
Computed Properties
Molecular Weight:490.5
XLogP3:0.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:490.14751164
Monoisotopic Mass:490.14751164
Topological Polar Surface Area:153
Heavy Atom Count:35
Complexity:760
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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