Retroisosenine
AlkaPlorer ID: AK090426
Synonym: ''
IUPAC Name: (1R,5R,7R,8S,18R)-5,7,8-trimethyl-2,10,19-trioxa-15-azatetracyclo[10.5.1.15,8.015,18]nonadec-12-ene-3,9-dione
Structure
SMILES: C[C@@H]1C[C@]2(C)CC(=O)O[C@@H]3CCN4CC=C(COC(=O)[C@@]1(C)O2)[C@H]34
InChI: InChI=1S/C18H25NO5/c1-11-8-17(2)9-14(20)23-13-5-7-19-6-4-12(15(13)19)10-22-16(21)18(11,3)24-17/h4,11,13,15H,5-10H2,1-3H3/t11-,13-,15-,17-,18+/m1/s1
InChIKey: KOYQLXLYMDNSGL-DZHCQNFQSA-N
Reference
Pyrrolizidine Alkaloids in Senecio nemorensis L. from Mongolia
PubChem CID: 21582622
LOTUS: LTS0213805
SuperNatural Ⅲ: SN0191492-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 335.40000000000003
TPSA？: 65.07
MolLogP？: 1.4331999999999998
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia salina | Artemia salina | LC50 | 300.0 | ug.mL-1 | 10.1021/np9702289 |
| Aspergillus niger | Aspergillus niger | Activity | nan | None | 10.1021/np9702289 |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1021/np9702289 |
| Trichoderma viride | Trichoderma viride | Activity | nan | None | 10.1021/np9702289 |