19-Epiiboxygaine
AlkaPlorer ID: AK040143
Synonym: '20-Epiiboxygaine', '19-epi-Iboxygaine', '20-epi-Iboxygaine'
IUPAC Name: 1-[(1R,15S,17R,18R)-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-17-yl]ethanol
Structure
SMILES: COC1=CC=C2NC3=C(CCN4C[C@H]5C[C@@H]3[C@@H]4[C@H](C(C)O)C5)C2=C1
InChI: InChI=1S/C20H26N2O2/c1-11(23)15-7-12-8-17-19-14(5-6-22(10-12)20(15)17)16-9-13(24-2)3-4-18(16)21-19/h3-4,9,11-12,15,17,20-21,23H,5-8,10H2,1-2H3/t11?,12-,15+,17+,20+/m1/s1
InChIKey: QLSITYRYHBQHBY-NWFPEMGYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phlojodicarpus sibiricus | Phlojodicarpus | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Ammi visnaga | Ammi | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Actaea cimicifuga | Actaea | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 326.44000000000005
TPSA？: 48.49
MolLogP？: 2.9074000000000018
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|