9-Angeloylretronecine
AlkaPlorer ID: AK016443
Synonym: '9-Angelylretronecine', '9-O-Angelylretronecine', 'Retronecine 9-(trans-2-methylcrotonate)', '9-Tigloylretronecine', '9-Tiglylretronecine'
IUPAC Name: [(7R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
Structure
SMILES: C/C=C(\C)C(=O)OCC1=CCN2CC[C@@H](O)C12
InChI: InChI=1S/C13H19NO3/c1-3-9(2)13(16)17-8-10-4-6-14-7-5-11(15)12(10)14/h3-4,11-12,15H,5-8H2,1-2H3/b9-3+/t11-,12?/m1/s1
InChIKey: VYUQPLFRNDQDHW-YKSZOPSQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lithospermum erythrorhizon | Lithospermum | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Arnebia euchroma | Arnebia | 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 |
|---|