N(4)-demethyl-12-methoxyalstogustine
AlkaPlorer ID: AK029401
Synonym: 'N(4)-Demethyl-12-methoxyalstogustine', 'Echitamidine; 12-Methoxy', '(-)-12-Methoxyechitamidine', '12-Methoxyechitamidine', '(-)-N(4)-Demethyl-12-methoxyalstogustine', 'Methyl (19R,20alpha)-19-hydroxy-12-methoxy-2,16-didehydrocuran-17-oate'
IUPAC Name: methyl (1S,11S,12S,17S)-12-[(1S)-1-hydroxyethyl]-6-methoxy-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(OC)C=CC=C3[C@]23CCN2C[C@@H]([C@H](C)O)[C@@H]1C[C@H]23
InChI: InChI=1S/C21H26N2O4/c1-11(24)13-10-23-8-7-21-14-5-4-6-15(26-2)18(14)22-19(21)17(20(25)27-3)12(13)9-16(21)23/h4-6,11-13,16,22,24H,7-10H2,1-3H3/t11-,12-,13-,16-,21-/m0/s1
InChIKey: FNDWOLJMJUSGOB-NKWDSHEASA-N
Reference
Terpenoid Indole Alkaloids from <i>Winchia </i><i>c</i><i>alophylla</i>
PubChem CID: 163011074
LOTUS: LTS0165419
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alstonia rostrata | Alstonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 370.4490000000001
TPSA？: 71.03
MolLogP？: 1.8904
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|