Scholaricine
AlkaPlorer ID: AK035050
Synonym: 'Echitamidine; 19,20-Diepimer, 12-hydroxy', 'Echitamidine; 20-Epimer, 12-hydroxy'
IUPAC Name: methyl (1R,11R,12R,17S)-6-hydroxy-12-[(1R)-1-hydroxyethyl]-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2(7),3,5,9-tetraene-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=C(O)C=CC=C3[C@@]23CCN2C[C@H]([C@@H](C)O)[C@H]1C[C@H]23
InChI: InChI=1S/C20H24N2O4/c1-10(23)12-9-22-7-6-20-13-4-3-5-14(24)17(13)21-18(20)16(19(25)26-2)11(12)8-15(20)22/h3-5,10-12,15,21,23-24H,6-9H2,1-2H3/t10-,11-,12-,15+,20-/m1/s1
InChIKey: GNCUCBQZLQLSOF-MYDFCGJWSA-N
Reference
Alkaloids from the leaves of Alstonia scholaris in Taiwan, Thailand, Indonesia and the Philippines
PubChem CID: 162982178
LOTUS: LTS0039618
SuperNatural Ⅲ: SN0110141-05
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alstonia scholaris | Alstonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 356.42200000000014
TPSA？: 82.03
MolLogP？: 1.5873999999999997
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|