N-Deethyldelphatine
AlkaPlorer ID: AK150928
Synonym: ''
IUPAC Name: (1S,2S,3S,4R,5S,6R,8S,9S,10S,13S,16S,17R,18R)-4,6,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
Structure
SMILES: COC[C@@]12CC[C@H](OC)[C@@]34[C@@H]1[C@@H](OC)[C@@](O)([C@H]3NC2)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2OC
InChI: InChI=1S/C24H39NO7/c1-28-11-21-7-6-15(30-3)23-13-8-12-14(29-2)9-22(26,16(13)17(12)31-4)24(27,20(23)25-10-21)19(32-5)18(21)23/h12-20,25-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17+,18+,19+,20-,21-,22-,23-,24+/m0/s1
InChIKey: MNNMFOYTLQAHNQ-CGGIMVBRSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum orientale | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 453.57600000000025
TPSA？: 98.64
MolLogP？: 0.1928000000000034
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|