UNPD53108
AlkaPlorer ID: AK023591
Synonym: None
IUPAC Name: [(1R,8R)-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-1-yl] 3-methylbut-2-enoate
Structure
SMILES: CC(C)=CC(=O)O[C@@H]1CCN2CC=C(CO)[C@H]12
InChI: InChI=1S/C13H19NO3/c1-9(2)7-12(16)17-11-4-6-14-5-3-10(8-15)13(11)14/h3,7,11,13,15H,4-6,8H2,1-2H3/t11-,13-/m1/s1
InChIKey: JWVMHVYNWULPCC-DGCLKSJQSA-N
Reference
Further pyrrolizidine alkaloids and furoeremophilanes from Senecio species
PubChem CID: 15286357
LOTUS: LTS0131226
SuperNatural Ⅲ: SN0177437-01
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Echium humile | Echium | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 237.299
TPSA？: 49.77
MolLogP？: 0.871
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|