Delnuttaline
AlkaPlorer ID: AK022137
Synonym: ''
IUPAC Name: [(1R,5R,8R,9S,10S,11S,14S,16R,17R,18S)-16,18-dihydroxy-5-methyl-12-methylidene-3-oxo-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-10-yl] acetate
Structure
SMILES: C=C1C[C@]23C[C@@]4(O)[C@@H]5[C@@]6(C)CC(=O)C[C@]57[C@@H]([C@H]2[C@@H](OC(C)=O)[C@H]1C[C@]37O)N4C6
InChI: InChI=1S/C22H27NO5/c1-10-4-19-8-21(26)17-18(3)5-12(25)6-20(17)16(23(21)9-18)14(19)15(28-11(2)24)13(10)7-22(19,20)27/h13-17,26-27H,1,4-9H2,2-3H3/t13-,14+,15-,16+,17+,18-,19-,20-,21+,22-/m0/s1
InChIKey: VOFHPANLWJZICP-ZASRTIFCSA-N
Reference
Diterpenoid and norditerpenoid alkaloids fromDelphinium nuttallianum
PubChem CID: 139053726
LOTUS: LTS0243628
SuperNatural Ⅲ: SN0395636-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium nuttallianum | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 385.46000000000015
TPSA？: 87.07
MolLogP？: 1.0071
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|