Zephyranthine
AlkaPlorer ID: AK012482
Synonym: '', '(+)-Zephyranthine', 'Trianthine', '(+)-Trianthine', 'Ungminoridine', '(+/-)-Zephyranthine', 'Zephyranthine'
IUPAC Name: (1S,15R,17S,18S,19R)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9-triene-17,18-diol
Structure
SMILES: O[C@H]1[C@H]2C3=CC4=C(C=C3CN3CC[C@H](C[C@@H]1O)[C@H]23)OCO4
InChI: InChI=1S/C16H19NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h4-5,8,11,14-16,18-19H,1-3,6-7H2/t8-,11+,14+,15-,16-/m1/s1
InChIKey: VJILFEGOWCJNIK-MGRBZGILSA-N
Reference
Amaryllidaceae Alkaloids from <i>Lycoris radiata</i>
PubChem CID: 11876135
LOTUS: LTS0230725
SuperNatural Ⅲ: SN0391868-13
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pancratium maritimum | Pancratium | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 289.331
TPSA？: 62.16000000000001
MolLogP？: 0.8284999999999998
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | IC50 | 10000.0 | nM | 10.1021/jm901031h |
| Homo sapiens | KB | IC50 | 50.0 | ug.mL-1 | 10.1016/j.bmcl.2019.126642 |
| Homo sapiens | SK-MEL-28 | IC50 | 10000.0 | nM | 10.1021/jm901031h |
| Leishmania donovani | Leishmania donovani | IC50 | 90.0 | ug.mL-1 | 10.1016/j.bmcl.2019.126642 |
| Mus musculus | B16-F10 | IC50 | 10000.0 | nM | 10.1021/jm901031h |
| Rattus norvegicus | L6 | IC50 | 26.99 | ug.mL-1 | 10.1016/j.bmcl.2019.126642 |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 3.1 | ug.mL-1 | 10.1016/j.bmcl.2019.126642 |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 21.37 | ug.mL-1 | 10.1016/j.bmcl.2019.126642 |
| None | NON-PROTEIN TARGET | IC50 | 10000.0 | nM | 10.1021/jm901031h |
| None | Unchecked | Ratio IC50 | 16.0 | None | 10.1016/j.bmcl.2019.126642 |