Gypsogenin
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Gypsogenin
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CAS No:
639-14-5
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Formula:
C30H46O4
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Chemical Name:
Gypsogenin
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Synonyms:
Olean-12-en-28-oic acid,3-hydroxy-23-oxo-,(3β,4α)-;Olean-12-en-28-oic acid,3β-hydroxy-23-oxo-;(3β,4α)-3-Hydroxy-23-oxoolean-12-en-28-oic acid;Gypsogenin;Githagenin;Albsapogenin;Gypsophilasapogenin;Astrantiagenin D
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CAS No:
Description
ChEBI: A sapogenin that is olean-12-en-28-oic acid substituted by a beta-hydroxy group at position 3 and an oxo group at position 23.
Gypsogenin is a sapogenin that is olean-12-en-28-oic acid substituted by a beta-hydroxy group at position 3 and an oxo group at position 23. It is a pentacyclic triterpenoid, a sapogenin, an aldehyde and a monocarboxylic acid. It derives from an oleanolic acid. It is a conjugate acid of a gypsogenin(1-).
Characteristics
74.60000
7.56
1.1±0.1 g/cm3
275 °C
581.1±50.0 °C at 760 mmHg
319.3±26.6 °C
1.564
D +91° (alc)
Gypsogenin Use and Manufacturing
Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C30 isoprenoids (triterpenes) [PR0106]
Computed Properties
Molecular Weight:470.7
XLogP3:6.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:470.33960994
Monoisotopic Mass:470.33960994
Topological Polar Surface Area:74.6
Heavy Atom Count:34
Complexity:936
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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