Aspidoalbidine; 11-Methoxy, 12-hydroxy, N-propanoyl
AlkaPlorer ID: AK289523
Synonym: Fendlerine, N-Propionyl-N-deacetylaspidolimidine
IUPAC Name: 1-(7-hydroxy-8-methoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6(11),7,9-trien-5-yl)propan-1-one
Structure
SMILES: CCC(=O)N1C2=C(O)C(OC)=CC=C2C23CCN4CCCC5(CCOC452)CCC13
InChI: InChI=1S/C23H30N2O4/c1-3-18(26)25-17-7-9-21-8-4-12-24-13-10-22(17,23(21,24)29-14-11-21)15-5-6-16(28-2)20(27)19(15)25/h5-6,17,27H,3-4,7-14H2,1-2H3
InChIKey: BQUQIANAVWLUAX-UHFFFAOYSA-N
Reference
Indole Alkaloids from the Trunk Bark of<i>Aspidosperma megalocarpon</i>
PubChem CID: 12309861
CAS: 4913-93-3
LOTUS: LTS0121241
COCONUT: CNP0240971.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspidosperma album | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 398.5030000000003
TPSA？: 62.24000000000001
MolLogP？: 3.1601000000000017
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|