(1S,3S,5R,6S)-6-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl benzoate
AlkaPlorer ID: AK425718
Synonym: None
IUPAC Name: (6-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) benzoate
Structure
SMILES: CN1C2CC(OC(=O)C3=CC=CC=C3)CC1C(OC(=O)C1=CC=CC=C1)C2
InChI: InChI=1S/C22H23NO4/c1-23-17-12-18(26-21(24)15-8-4-2-5-9-15)14-19(23)20(13-17)27-22(25)16-10-6-3-7-11-16/h2-11,17-20H,12-14H2,1H3
InChIKey: JRPXXGFURWDPJS-UHFFFAOYSA-N
Reference
Alkaloids of Erythroxylum cuneatum, E. ecarinatum and E. australe
PubChem CID: 162912052
LOTUS: LTS0226658
COCONUT: CNP0180987.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythroxylum cuneatum | Erythroxylum | Erythroxylaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 365.42900000000014
TPSA？: 55.84
MolLogP？: 3.304100000000002
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|