Thalicsessine
AlkaPlorer ID: AK047018
Synonym: '', 'Thalicsessine'
IUPAC Name: (1S,5R,8R,9S,11R,14S,17S,18R)-7-(2-hydroxyethyl)-5-methyl-12-methylidene-7-azahexacyclo[9.6.2.01,8.05,17.09,14.014,18]nonadecane-6,16,19-trione
Structure
SMILES: C=C1C[C@]23CC(=O)[C@H]4[C@]56CCC[C@@]4(C)C(=O)N(CCO)[C@@H]5[C@H]2C[C@H]1C(=O)[C@H]36
InChI: InChI=1S/C22H27NO4/c1-11-9-21-10-14(25)16-20(2)4-3-5-22(16)17(21)15(26)12(11)8-13(21)18(22)23(6-7-24)19(20)27/h12-13,16-18,24H,1,3-10H2,2H3/t12-,13-,16-,17-,18-,20-,21+,22+/m1/s1
InChIKey: SOOGRVQQQMCVQZ-CIIHXBACSA-N
Reference
Thalocsessine, a New C20-Diterpenoid Alkaloid from Thalictrum sessile Hayata
PubChem CID: 102482182
LOTUS: LTS0185473
SuperNatural Ⅲ: SN0351165-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thalictrum javanicum | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 369.46100000000007
TPSA？: 74.68
MolLogP？: 1.7364000000000002
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|