Akuammicine; (-)-form, 19,20-Dihydro, 18- or 19-hydroxy
AlkaPlorer ID: AK035558
Synonym: '', 'Echitamidine', 'Hydroxy-19,20-dihydroakuammicine'
IUPAC Name: methyl (1R,11S,12S,17S)-12-[(1S)-1-hydroxyethyl]-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3[C@@]23CCN2C[C@@H]([C@H](C)O)[C@@H]1C[C@H]23
InChI: InChI=1S/C20H24N2O3/c1-11(23)13-10-22-8-7-20-14-5-3-4-6-15(14)21-18(20)17(19(24)25-2)12(13)9-16(20)22/h3-6,11-13,16,21,23H,7-10H2,1-2H3/t11-,12-,13-,16-,20+/m0/s1
InChIKey: DWLJVOJBWLYMJO-AXRAJECPSA-N
Reference
Indole alkaloids fromAlstonia glaucescens
PubChem CID: 10991442
LOTUS: LTS0143128
SuperNatural Ⅲ: SN0077332-02
NPASS: NPC162671
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Plumbago indica | Plumbago | Plumbaginaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Alstonia scholaris | Alstonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Echinops ritro | Echinops | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 340.42300000000006
TPSA？: 61.8
MolLogP？: 1.8818
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|