(+)-Hecogenin
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(+)-Hecogenin
structure -
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CAS No:
467-55-0
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Formula:
C27H42O4
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Chemical Name:
(+)-Hecogenin
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Synonyms:
Spirostan-12-one,3-hydroxy-,(3β,5α,25R)-;5α-Spirostan-12-one,3β-hydroxy-,(25R)-;5α,25D-Spirostan-12-one,3β-hydroxy-;(3β,5α,25R)-3-Hydroxyspirostan-12-one;Hecogenin;Hocogenin;(25R)-3β-Hydroxy-5α-spirostan-12-one;12-Oxotigogenin;Gekogenin;(+)-Hecogenin;NSC 115921;Hekogenin;25(R)-3β-Hydroxyspirostan-12-one;3β-Hydroxy-5α-hecogenin;(25R)-3b-Hydroxy-5a-spirostan-12-one;1368-00-9;27067-83-0
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CAS No:
Description
Hecogenin is a steroid saponin isolated from Agave sisalana and is a selective inhibitor of human UDP-glucuronosyltransferases. Hecogenin has a wide spectrum of pharmacological activities, including anti-inflammatory, antifungal and gastroprotective effects[1].
Hecogenin is a triterpenoid.
Characteristics
55.8
4.22
White solid.
1.2±0.1 g/cm3
266.5 °C
548.9±50.0 °C at 760 mmHg
177.8±23.6 °C
1.559
2.45E-14mmHg at 25°C
7.2 º (c=0.8 g/100ml, CHCl3)
Safety Information
3
R36/37/38:Irritating to eyes, respiratory system and skin .
S26-S36
Xi
P264, P280, P305+P351+P338, P33, P313
H319
(+)-Hecogenin Use and Manufacturing
Available Hechtia texensis, Agave genus and other cassia extract.
antiinflammatory
Lipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Spirostanols and derivatives [ST0108]
Computed Properties
Molecular Weight:430.6
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:430.30830982
Monoisotopic Mass:430.30830982
Topological Polar Surface Area:55.8
Heavy Atom Count:31
Complexity:766
Defined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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