UNPD8990
AlkaPlorer ID: AK024386
Synonym: None
IUPAC Name: [(7R,8S)-7-[(Z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R,3S)-2,3-dihydroxy-2-(hydroxymethyl)butanoate
Structure
SMILES: C/C=C(/C)C(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@@](O)(CO)[C@H](C)O)[C@@H]12
InChI: InChI=1S/C18H27NO7/c1-4-11(2)16(22)26-14-6-8-19-7-5-13(15(14)19)9-25-17(23)18(24,10-20)12(3)21/h4-5,12,14-15,20-21,24H,6-10H2,1-3H3/b11-4-/t12-,14+,15-,18+/m0/s1
InChIKey: IMZYUCHNYPUYBN-YKHUJKCBSA-N
Reference
Pyrrolizidine alkaloids from Alkanna tinctoria
PubChem CID: 162958001
LOTUS: LTS0178671
SuperNatural Ⅲ: SN0149937-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alkanna tinctoria | Alkanna | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 369.414
TPSA？: 116.53
MolLogP？: -0.4738999999999989
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|