[(7R,7aR)-7-{[(2R)-2-methylbutanoyl]oxy}-5,6,7,7a-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R,3S)-2,3-dihydroxybutanoate
AlkaPlorer ID: AK023655
Synonym: None
IUPAC Name: [(1R,8R)-7-[[(2R,3S)-2,3-dihydroxybutanoyl]oxymethyl]-2,3,5,8-tetrahydro-1H-pyrrolizin-1-yl] (2R)-2-methylbutanoate
Structure
SMILES: CC[C@@H](C)C(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@H](O)[C@H](C)O)[C@H]12
InChI: InChI=1S/C17H27NO6/c1-4-10(2)16(21)24-13-6-8-18-7-5-12(14(13)18)9-23-17(22)15(20)11(3)19/h5,10-11,13-15,19-20H,4,6-9H2,1-3H3/t10-,11+,13-,14-,15-/m1/s1
InChIKey: URBUCYRYSVLIOW-OBRUSBNWSA-N
Reference
Pyrrolizidine and tetrahydroisoquinoline alkaloids from Echium humile
PubChem CID: 163012124
LOTUS: LTS0146253
SuperNatural Ⅲ: SN0377907-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Echium humile | Echium | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 341.40399999999994
TPSA？: 96.3
MolLogP？: 0.2435000000000003
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|