16-Demethyldelsoline
AlkaPlorer ID: AK115807
Synonym: ''
IUPAC Name: (1S,2S,3S,4S,5S,6R,8S,9S,10S,13S,16S,17R,18R)-11-ethyl-4,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-6,8,9,16-tetrol
Structure
SMILES: CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](OC)[C@@](O)([C@@H]13)[C@]1(O)C[C@@H](O)[C@@H]2C[C@H]4[C@H]1[C@H]2OC
InChI: InChI=1S/C24H39NO7/c1-5-25-10-21(11-30-2)7-6-15(27)23-13-8-12-14(26)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+/m0/s1
InChIKey: CNQPCEHJNXDHTH-KZAMOUAFSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium grandiflorum | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 453.5760000000002
TPSA？: 111.85000000000002
MolLogP？: -0.3830999999999966
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|