Aconosine
AlkaPlorer ID: AK017549
Synonym: ''
IUPAC Name: (1S,2R,3R,4R,5S,6S,8S,9R,10S,13S,16R,17S)-11-ethyl-6,16-dimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol
Structure
SMILES: CCN1C[C@H]2CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@H](C[C@@H]23)[C@H]14
InChI: InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16+,17-,18-,19-,20+,21+,22-/m1/s1
InChIKey: VCOQRRVEIUTMFC-QNCXWZNESA-N
Reference
Bisnorditerpene, Norditerpene, and Lipo-alkaloids from<i>Aconitum toxicum</i>
PubChem CID: 163006592
LOTUS: LTS0126090
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum piepunense | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 377.52500000000015
TPSA？: 62.16000000000001
MolLogP？: 1.5146000000000002
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|