Trichodesmine; 13-Deoxy
AlkaPlorer ID: AK316321
Synonym: Incanine
IUPAC Name: 6-hydroxy-5,6-dimethyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione
Structure
SMILES: CC(C)C1C(=O)OC2CCN3CC=C(COC(=O)C(C)(O)C1C)C23
InChI: InChI=1S/C18H27NO5/c1-10(2)14-11(3)18(4,22)17(21)23-9-12-5-7-19-8-6-13(15(12)19)24-16(14)20/h5,10-11,13-15,22H,6-9H2,1-4H3
InChIKey: DSYFCKQYQRJSLW-UHFFFAOYSA-N
Reference
Preparative separation of pyrrolizidine alkaloids by high-speed counter-current chromatography
PubChem CID: 164616
CAS: 480-77-3
LOTUS: LTS0071000
COCONUT: CNP0359448.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trichodesma incanum | Trichodesma | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Heliotropium | Heliotropiaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Heliotropium | Heliotropiaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 337.416
TPSA？: 76.07
MolLogP？: 1.1285999999999998
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|