Ajaconine
AlkaPlorer ID: AK319630
Synonym: None
IUPAC Name: (1S,5R,10R,12R,14S,16R,17R)-7-(2-hydroxyethyl)-5-methyl-13-methylidene-9-oxa-7-azahexacyclo[8.6.2.211,14.01,8.05,17.011,16]icosan-12-ol
Structure
SMILES: C=C1[C@H]2CCC3([C@@H]1O)[C@@H](C2)[C@@]12CCC[C@@]4(C)CN(CCO)C1O[C@@H]3C[C@H]42
InChI: InChI=1S/C22H33NO3/c1-13-14-4-7-22(18(13)25)16(10-14)21-6-3-5-20(2)12-23(8-9-24)19(21)26-17(22)11-15(20)21/h14-19,24-25H,1,3-12H2,2H3/t14-,15+,16-,17+,18+,19?,20-,21-,22?/m0/s1
InChIKey: RLXRCZIALRMBJR-MOXMPTFTSA-N
Reference
NPASS: NPC280116
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium tatsienense | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Consolida ajacis | Consolida | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 359.51000000000005
TPSA？: 52.93000000000001
MolLogP？: 2.549100000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|