UNPD139056
AlkaPlorer ID: AK195917
Synonym: None
IUPAC Name: [(1S,8R)-8-methyl-1,2,3,5,6,7-hexahydropyrrolizin-1-yl]methyl 4-hydroxy-3-methoxy-5-(3-methylbut-2-enyl)benzoate
Structure
SMILES: COC1=CC(C(=O)OC[C@H]2CCN3CCC[C@]23C)=CC(CC=C(C)C)=C1O
InChI: InChI=1S/C22H31NO4/c1-15(2)6-7-16-12-17(13-19(26-4)20(16)24)21(25)27-14-18-8-11-23-10-5-9-22(18,23)3/h6,12-13,18,24H,5,7-11,14H2,1-4H3/t18-,22-/m1/s1
InChIKey: IYWSIDKNUJVAFH-XMSQKQJNSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Liparis cordifolia | Liparis | Orchidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 373.4930000000001
TPSA？: 59.0
MolLogP？: 3.940700000000004
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|