(+)-Darvasine
AlkaPlorer ID: AK080094
Synonym: 'Darvasine'
IUPAC Name: (1S,2S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadec-8-en-6-one
Structure
SMILES: O=C1CCC[C@H]2[C@@H]3CCCN4CCCC(=CN12)[C@H]34
InChI: InChI=1S/C15H22N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h10,12-13,15H,1-9H2/t12-,13-,15+/m0/s1
InChIKey: QIFZCGKECLUFGM-KCQAQPDRSA-N
Reference
PubChem CID: 201655
CAS: 6475-07-6
LOTUS: LTS0140763
SuperNatural Ⅲ: SN0306137-05
NPASS: NPC218521
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| [Clostridium] symbiosum | Lachnoclostridium | Lachnospiraceae | Eubacteriales | Clostridia | Bacillota | None | Bacteria |
| Fraxinus malacophylla | Fraxinus | Oleaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Sphaeranthus bullatus | Sphaeranthus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 246.354
TPSA？: 23.550000000000004
MolLogP？: 2.1394
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|