(1S,10S,13R,14R,15Z,22S)-15-ethylidene-4,10-dimethoxy-17-methyl-11-oxa-8,17-diazapentacyclo[12.5.2.1¹,⁸.0²,⁷.0¹³,²²]docosa-2(7),3,5-triene-9,20-dione
AlkaPlorer ID: AK239495
Synonym: None
IUPAC Name: (1S,10R,13R,14R,22S)-15-ethylidene-4,10-dimethoxy-17-methyl-11-oxa-8,17-diazapentacyclo[12.5.2.11,8.02,7.013,22]docosa-2(7),3,5-triene-9,20-dione
Structure
SMILES: CC=C1CN(C)CC[C@]23C(=O)C[C@@H]1[C@H]1CO[C@@H](OC)C(=O)N(C4=CC=C(OC)C=C42)[C@@H]13
InChI: InChI=1S/C24H30N2O5/c1-5-14-12-25(2)9-8-24-18-10-15(29-3)6-7-19(18)26-21(24)17(16(14)11-20(24)27)13-31-23(30-4)22(26)28/h5-7,10,16-17,21,23H,8-9,11-13H2,1-4H3/t16-,17+,21-,23+,24+/m0/s1
InChIKey: ZCTHOTXPRNWRNQ-SHAYLMCUSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos henningsii | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 426.51300000000015
TPSA？: 68.31
MolLogP？: 2.1378999999999992
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|