Gigactonine
AlkaPlorer ID: AK018059
Synonym: ''
IUPAC Name: (1R,2R,3R,4S,5R,6R,8R,9R,10R,13R,16R,17S,18S)-11-ethyl-13-(hydroxymethyl)-4,6,18-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol
Structure
SMILES: CCN1C[C@@]2(CO)CC[C@@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@H]6OC)[C@@](O)([C@H]13)[C@@H](OC)[C@@H]24
InChI: InChI=1S/C24H39NO7/c1-5-25-10-21(11-26)7-6-15(27)23-13-8-12-14(30-2)9-22(28,16(13)17(12)31-3)24(29,20(23)25)19(32-4)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12-,13-,14-,15-,16-,17+,18+,19+,20-,21-,22-,23-,24+/m1/s1
InChIKey: DKODPYKVVJKLFU-ITFRFWLPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Consolida oliveriana | Consolida | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 453.5760000000002
TPSA？: 111.85000000000002
MolLogP？: -0.3830999999999975
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|