UNPD79870
AlkaPlorer ID: AK199097
Synonym: None
IUPAC Name: (1S,10R,13S,14S,20R,22R)-15-ethylidene-10-hydroxy-4-methoxy-11-oxa-8,17-diazahexacyclo[12.5.2.11,8.02,7.017,20.013,22]docosa-2(7),3,5-trien-9-one
Structure
SMILES: CC=C1CN2CC[C@]34C5=CC(OC)=CC=C5N5C(=O)[C@H](O)OC[C@@H]([C@@H]1C[C@@H]23)[C@@H]54
InChI: InChI=1S/C22H26N2O4/c1-3-12-10-23-7-6-22-16-8-13(27-2)4-5-17(16)24-19(22)15(14(12)9-18(22)23)11-28-21(26)20(24)25/h3-5,8,14-15,18-19,21,26H,6-7,9-11H2,1-2H3/t14-,15+,18-,19-,21-,22+/m1/s1
InChIKey: YWAATWSJCWDKMD-OWQJPLLCSA-N
Reference
Nouveaux alcaloïdes isolés d'un Strychnos henningsii, d'origine malgache
PubChem CID: 163101756
LOTUS: LTS0125586
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos henningsii | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 382.46000000000015
TPSA？: 62.24000000000001
MolLogP？: 1.6670999999999998
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|