humantenirine
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Grundinformationen
- CAS
82375-30-2- Standard-SMILES
C/C=C1\CN[C@H]2C[C@@]3(C(=O)N(OC)c4cc(OC)ccc43)[C@@H]3C[C@H]1[C@@H]2CO3- InChIKey
ZORKKCARNQAZRJ-WQMYVFALSA-N- Summenformel
- C21H26N2O4
- Durchschnittliche Molmasse
- 370,44 g/mol
Namen und Bezeichner
- Bevorzugter Name
- humantenirine
- Englischer Name
- humantenirine
- Summenformel
- C21H26N2O4
- Molmasse
- 370.44
Namen und Synonyme
Humanlenirinehumantenirine4-Demethyl-11-methoxyhumantenineSpiro[3H-indole-3,8'(7'H)-[4,7]methanooxepino[4,3-b]pyridin]-2(1H)-one, 3'-ethylidene-1',2',3',4',4'a,5',9',9'a-octahydro-1,6-dimethoxy-, (3S,3'Z,4'R,4'aS,7'R,9'aS)-
Datenbank-Bezeichner
- CAS
82375-30-2- PubChem CID
- 6441961
Eigenschaften
Physikochemische Eigenschaften
- Siedepunkt
- 531.13 · 531.130±60.00 °C(Press: 760.00 Torr)(predicted)
- Dichte
- 1.302 · 1.302±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- Löslichkeit
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- Aggregatzustand
- Powder
- pka
- 9.197 · 9.197±0.20(predicted)
- InChIKey
- ZORKKCARNQAZRJ-WQMYVFALSA-N
- SMILES
- N1(OC)C2=C(C=CC(OC)=C2)[C@@]2([C@@]3([H])C[C@@]4([H])/C(=C/C)/CN[C@@]([H])(C2)[C@@]4([H])CO3)C1=O
Chemie und Industrie
Anwendungen
BeschreibungHumantenirine is an oxindole alkaloid that has been shown to have potent inhibition of the enzyme activities. It is a natural product that has been isolated from the plant Humantenia nitens, which is found in Gabon, Africa. Humantenirine has a skeleton similar to other indole alkaloids and contains a hydroxy group on one of the rings. This compound has been shown to be stereoselective and monoterpenoid and may have potential as an anti-inflammatory drug.
OccurrenceHumantenirine is a natural product found in Gelsemium sempervirens, Gelsemium elegans, and Gelsemium rankinii with data available.
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