cassiarin D
AlkaPlorer ID: AK033974
Synonym: '(-)-Cassiarin D', 'Cassiarin D'
IUPAC Name: 7-hydroxy-2-[[(3R)-11-hydroxy-3,7-dimethyl-2-oxa-6-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-3-yl]methyl]-5-(2-oxopropyl)chromen-4-one
Structure
SMILES: CC(=O)CC1=CC(O)=CC2=C1C(=O)C=C(C[C@@]1(C)CC3=NC(C)=CC4=CC(O)=CC(=C34)O1)O2
InChI: InChI=1S/C26H23NO6/c1-13-4-15-6-18(30)9-23-24(15)20(27-13)12-26(3,33-23)11-19-10-21(31)25-16(5-14(2)28)7-17(29)8-22(25)32-19/h4,6-10,29-30H,5,11-12H2,1-3H3/t26-/m0/s1
InChIKey: HZJJDGVISZWXLO-SANMLTNESA-N
Reference
Cassiarins C−E, Antiplasmodial Alkaloids from the Flowers of <i>Cassia siamea</i>
PubChem CID: 162995367
LOTUS: LTS0150029
SuperNatural Ⅲ: SN0139604-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Senna siamea | Senna | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 445.4710000000002
TPSA？: 109.86
MolLogP？: 4.128620000000004
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|