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99572-22-2

99572-22-2 Structure

99572-22-2 Structure
IdentificationBack Directory
[Name]

(4R,4aβ,7aα,11aβ,14aα)-4β,11β-Dihydroxy-6aα,13aα-di(methylthio)-4,4a,6a,7,11,11a,14,14a-octahydro-1H,6H-pyrazino[1,2-a:4,5-a']diindole-1,6,8,13(7aH,13aH)-tetrone
[CAS]

99572-22-2
[Synonyms]

Exserohilone
PubChem ID: 188607
(4R,4aβ,7aα,11aβ,14aα)-4β,11β-Dihydroxy-6aα,13aα-di(methylthio)-4,4a,6a,7,11,11a,14,14a-octahydro-1H,6H-pyrazino[1,2-a:4,5-a']diindole-1,6,8,13(7aH,13aH)-tetrone
1H,6H-Pyrazino[1,2-a:4,5-a']diindole-1,6,8,13(4H,6aH)-tetrone, 4a,7,7a,11,11a,13a,14,14a-octahydro-4,11-dihydroxy-6a,13a-bis(methylthio)-, (4R,4aR,6aS,7aR,11R,11aR,13aS,14aR)-rel-(-)- (9CI)
[Molecular Formula]

C20H22N2O6S2
[MOL File]

99572-22-2.mol
[Molecular Weight]

450.52
Chemical PropertiesBack Directory
[Boiling point ]

812.6±65.0 °C(Predicted)
[density ]

1.62±0.1 g/cm3(Predicted)
[pka]

11.81±0.70(Predicted)
Hazard InformationBack Directory
[Uses]

Exserohilone ((-)-Exserohilone) is a thiodiketopiperazine derivative that exhibits the inhibition of TNF-α-induced ROS generation and MMP-1 secretion. Exserohilone increases the procollagen type I α1 secretion in human dermal fibroblasts[1].
[References]

[1] Haeun Kwon, et al. Mass spectrometry-guided isolation of thiodiketopiperazines from an EtOAc-extract of Setosphaeria rostrata culture medium and their anti-skin aging effects on TNF-α-induced human dermal fibroblasts. J Antibiot (Tokyo). 2024 Jan 19. DOI:10.1038/s41429-023-00702-2
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