Psoralidin
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Grundinformationen
- CAS
18642-23-4- Standard-SMILES
CC(C)=CCc1cc2c(cc1O)oc(=O)c1c3ccc(O)cc3oc21- InChIKey
YABIJLLNNFURIJ-UHFFFAOYSA-N- Summenformel
- C20H16O5
- Durchschnittliche Molmasse
- 336,343 g/mol
- Monoisotopische Masse
- 336,09977361
Namen und Bezeichner
- Bevorzugter Name
- Psoralidin
- IUPAC
- 3,9-Dihydroxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one
- Englischer Name
- psoralidin
- Summenformel
- C20H16O5
- Molmasse
- 336.34
Namen und Synonyme
PsorslidinpsoralidinPsoralidin-RMPsoralidin, BRPsoralidin (6CI)Psoralidin, >=99%Psoralidin (Standard)Psoralidin, 10 mM in DMSO3,9-Dihydroxy-2-prenylcoumestan3,9-dihydroxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one
Datenbank-Bezeichner
- CAS
18642-23-4- PubChem CID
- 5281806
- DTXSID
DTXSID20171903- ChEMBL
CHEMBL4064323- ChEBI
CHEBI:8616- UNII
- G16ZUQ069L
- EC Number
- 683-176-7
- Nikkaji
- J14.254I
Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 290 · 290-292°
- Siedepunkt
- 458.8 · 458.8±34.0 °C(Predicted)
- Dichte
- 1.383 · 1.383±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- Löslichkeit
- 5 mg/mL, · DMSO: soluble5mg/mL, clear (warmed)
- Aggregatzustand
- powder
- pka
- 8.7 · 8.70±0.20(Predicted)
- Farbe
- white to beige
- InChI
- 1S/C20H16O5/c1-10(2)3-4-11-7-14-17(9-15(11)22)25-20(23)18-13-6-5-12(21)8-16(13)24-19(14)18/h3,5-9,21-22H,4H2,1-2H3
- InChIKey
- YABIJLLNNFURIJ-UHFFFAOYSA-N
- SMILES
- CC(C)=CCC1=C(C=C(OC2=O)C(C(OC3=C4)=C2C3=CC=C4O)=C1)O
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2932.20.4500
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 Oral
Chemie und Industrie
Anwendungen
BeschreibungPsoralidin is a furanocoumarin isolated from the seeds of P. corylifolia, a medicinal plant found in southeastern Asia, that has been shown to induce cytotoxicity against various cancer cells. Through TNF-related apoptosis-inducing ligand-mediated events, psoralidin at 50 μM can induce the death of HeLa cancer cells. It also can induce apoptosis of androgen-dependent (LNCaP, C4-2B) and androgen-independent (DU-145, PC-3) prostate cancer cells and inhibit the growth of PC-3 xenograft tumors in nude mice.
VerwendenPsoralidin is an antibacterial and antioxidant reagent.
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Ergänzende Hinweise
DefinitionChEBI: A member of the class of coumestans that is coumestan substituted by hydroxy groups at positions 3 and 9 and a prenyl group at position 2 respectively.
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