Aspidoalbidine; 10,11-Dimethoxy, 12-hydroxy, N-Ac
AlkaPlorer ID: AK289517
Synonym: Kromantine, N-Acetyl-N-depropionylaspidoalbine
IUPAC Name: 1-(7-hydroxy-8,9-dimethoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6,8,10-trien-5-yl)ethanone
Structure
SMILES: COC1=CC2=C(C(O)=C1OC)N(C(C)=O)C1CCC34CCCN5CCC21C53OCC4
InChI: InChI=1S/C23H30N2O5/c1-14(26)25-17-5-7-21-6-4-10-24-11-8-22(17,23(21,24)30-12-9-21)15-13-16(28-2)20(29-3)19(27)18(15)25/h13,17,27H,4-12H2,1-3H3
InChIKey: RRBZDBHWSABCEC-UHFFFAOYSA-N
Reference
Alkaloids of three Aspidosperma species
PubChem CID: 550059
LOTUS: LTS0198688
COCONUT: CNP0314326.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Aspidosperma album | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 414.5020000000004
TPSA？: 71.47
MolLogP？: 2.778600000000001
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|