Trachelanthamine; 3'-Ac
AlkaPlorer ID: AK252048
Synonym: 3'-O-Acetyltrachelanthamine
IUPAC Name: 2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl 2-(1-acetyloxyethyl)-2-hydroxy-3-methylbutanoate
Structure
SMILES: CC(=O)OC(C)C(O)(C(=O)OCC1CCN2CCCC12)C(C)C
InChI: InChI=1S/C17H29NO5/c1-11(2)17(21,12(3)23-13(4)19)16(20)22-10-14-7-9-18-8-5-6-15(14)18/h11-12,14-15,21H,5-10H2,1-4H3
InChIKey: OPIPQZJQFXCYJD-UHFFFAOYSA-N
Reference
Bioactive saturated pyrrolizidine alkaloids from Heliotropium floridum
PubChem CID: 85274135
LOTUS: LTS0124549
COCONUT: CNP0277644
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Heliotropium floridum | Heliotropium | Heliotropiaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 327.42100000000005
TPSA？: 76.07
MolLogP？: 1.3525999999999998
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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