(1S,2R,4R,5R,6R,8S,9S,10S,13S,16S,17R,18S,20S)-11-ethyl-8,9,16-trihydroxy-18,20-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.2⁴,⁸.0¹,¹⁰.0²,⁶.0¹³,¹⁷]icosan-5-yl acetate
AlkaPlorer ID: AK506189
Synonym: None
IUPAC Name: [11-ethyl-8,9,16-trihydroxy-18,20-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.24,8.01,10.02,6.013,17]icosan-5-yl] acetate
Structure
SMILES: CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(CC5C6OC(C)=O)C(O)(C(OC)C23)C14
InChI: InChI=1S/C27H43NO8/c1-6-28-12-24(13-33-3)8-7-19(30)26-17-9-15-18(34-4)11-25(31,10-16(17)20(15)36-14(2)29)27(32,23(26)28)22(35-5)21(24)26/h15-23,30-32H,6-13H2,1-5H3
InChIKey: QWNOCXABDPZOJQ-UHFFFAOYSA-N
Reference
Norditerpenoid alkaloids of Delphinium leroyi
PubChem CID: 162880794
LOTUS: LTS0226347
COCONUT: CNP0146488.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium leroyi | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 509.6400000000003
TPSA？: 117.92000000000002
MolLogP？: 0.577800000000003
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|