Soyasapogenol B
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Soyasapogenol B
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CAS No:
595-15-3
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Formula:
C30H50O3
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Chemical Name:
Soyasapogenol B
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Synonyms:
Olean-12-ene-3,22,23-triol,(3β,4β,22β)-;Olean-12-ene-3β,22β,24-triol;Soyasapogenol B;(3β,4β,22β)-Olean-12-ene-3,22,23-triol;3β,22β,24-Trihydroxyolean-12-ene;Soyasapogenin B;Olean-12-en-3β,22β,24-triol;Soyasapogenol I;1174209-23-4
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CAS No:
Description
Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2].
Solid
Soyasapogenol B is a pentacyclic triterpenoid that is oleanane containing a double bond between positions 12 and 13 and substituted by hydroxy groups at the 3beta, 22beta and 24-positions. It derives from a hydride of an oleanane.
Characteristics
60.69000
7.41
Solid
1.1±0.1 g/cm3
259-260 °C
555.5±50.0 °C at 760 mmHg
226.6±24.7 °C
1.562
Computed Properties
Molecular Weight:458.7
XLogP3:7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:458.37599545
Monoisotopic Mass:458.37599545
Topological Polar Surface Area:60.7
Heavy Atom Count:33
Complexity:848
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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