Alstoscholarine; (E)-form
AlkaPlorer ID: AK034964
Synonym: 'Alstoscholarine; (Z)-form'
IUPAC Name: methyl 13-ethylidene-17-formyl-3,18-diazapentacyclo[10.6.1.02,10.04,9.014,18]nonadeca-2(10),4,6,8,14,16-hexaene-11-carboxylate
Structure
SMILES: CC=C1C2=CC=C(C=O)N2C2CC1C(C(=O)OC)C1=C2NC2=CC=CC=C12
InChI: InChI=1S/C22H20N2O3/c1-3-13-15-10-18(24-12(11-25)8-9-17(13)24)21-19(20(15)22(26)27-2)14-6-4-5-7-16(14)23-21/h3-9,11,15,18,20,23H,10H2,1-2H3
InChIKey: LMQWGENTCNSYQP-UHFFFAOYSA-N
Reference
Unique Monoterpenoid Indole Alkaloids from <i>Alstonia scholaris</i>
PubChem CID: 162935818
LOTUS: LTS0161291
COCONUT: CNP0205914
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alstonia scholaris | Alstonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 360.413
TPSA？: 64.09
MolLogP？: 4.064700000000003
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|