Dihydroxytriangularine
AlkaPlorer ID: AK296474
Synonym: None
IUPAC Name: [7-(2-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl 2,3-dihydroxy-2-(hydroxymethyl)butanoate
Structure
SMILES: CC=C(C)C(=O)OC1CCN2CC=C(COC(=O)C(O)(CO)C(C)O)C12
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
InChIKey: IMZYUCHNYPUYBN-UHFFFAOYSA-N
Reference
Pyrrolizidine alkaloids from Alkanna tinctoria
PubChem CID: 162958000
LOTUS: LTS0052377
COCONUT: CNP0228944.3
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 |
|---|