Sarmentine
AlkaPlorer ID: AK321894
Synonym: None
IUPAC Name: (2E,4E)-1-pyrrolidin-1-yldeca-2,4-dien-1-one
Structure
SMILES: CCCCC/C=C/C=C/C(=O)N1CCCC1
InChI: InChI=1S/C14H23NO/c1-2-3-4-5-6-7-8-11-14(16)15-12-9-10-13-15/h6-8,11H,2-5,9-10,12-13H2,1H3/b7-6+,11-8+
InChIKey: BFZBGTMIBOQWBA-HRCSPUOPSA-N
Reference
Pipersarmenoids, new amide alkaloids from Piper sarmentosum
Phytotoxicity of Sarmentine Isolated from Long Pepper (<i>Piper longum</i>) Fruit
PubChem CID: 6440616
CAS: 78910-33-5
LOTUS: LTS0276326
SuperNatural Ⅲ: SN0024461-02
NPASS: NPC385
data_source: manually
Source
Properties Information
Molecule Weight: 221.3439999999999
TPSA？: 20.31
MolLogP？: 3.3015000000000017
Number of H-Donors: 0
Number of H-Acceptors: 1
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Amaranthus retroflexus | Amaranthus retroflexus | mortality | 80.0 | % | 10.1021/jf102087c |
| Chenopodium album | Chenopodium album | mortality | 80.0 | % | 10.1021/jf102087c |
| Convolvulus arvensis | Convolvulus arvensis | mortality | 80.0 | % | 10.1021/jf102087c |
| Cyperus difformis | Cyperus difformis | mortality | 20.0 | % | 10.1021/jf102087c |
| Digitaria sanguinalis | Digitaria sanguinalis | mortality | 80.0 | % | 10.1021/jf102087c |
| Echinochloa crus-galli | Echinochloa crus-galli | mortality | 80.0 | % | 10.1021/jf102087c |
| Erigeron canadensis | Erigeron canadensis | mortality | 20.0 | % | 10.1021/jf102087c |
| Homo sapiens | A549 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | DU-145 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | HL-60 | IC50 | 50000.0 | nM | 10.1021/jm301064b |
| Homo sapiens | KB | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | MCF7 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | MDA-MB-231 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | SK-BR-3 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Homo sapiens | ZR-75-1 | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| Leptochloa | Leptochloa | mortality | 80.0 | % | 10.1021/jf102087c |
| Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | 50.0 | ug.mL-1 | 10.1016/j.ejmech.2011.12.029 |
| Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | 50.0 | ug.mL-1 | 10.1016/j.ejmech.2017.06.005 |
| Oryza sativa | Oryza sativa | mortality | nan | None | 10.1021/jf102087c |
| Poa annua | Poa annua | mortality | 80.0 | % | 10.1021/jf102087c |
| Rumex crispus | Rumex crispus | mortality | 80.0 | % | 10.1021/jf102087c |
| Sinapis arvensis | Sinapis arvensis | mortality | 80.0 | % | 10.1021/jf102087c |
| Solanum nigrum | Solanum nigrum | mortality | 80.0 | % | 10.1021/jf102087c |
| Taraxacum officinale | Taraxacum officinale | mortality | 80.0 | % | 10.1021/jf102087c |
| Triticum aestivum | Triticum aestivum | mortality | 80.0 | % | 10.1021/jf102087c |
| Zea mays | Zea mays | mortality | 80.0 | % | 10.1021/jf102087c |
| None | NON-PROTEIN TARGET | IC50 | 40000.0 | nM | 10.1016/j.bmcl.2014.08.063 |
| None | NON-PROTEIN TARGET | IC50 | 50000.0 | nM | 10.1021/jm301064b |