Scaevodimerine A; 1',2'-Didehydro
AlkaPlorer ID: AK313015
Synonym: Scaevodimerine B
IUPAC Name: (4-methoxycarbonyl-7-methyl-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-yl) 1-methyl-2,7-naphthyridine-4-carboxylate
Structure
SMILES: COC(=O)C1=CNCC2C1CC(OC(=O)C1=CN=C(C)C3=CN=CC=C13)C2C
InChI: InChI=1S/C21H23N3O4/c1-11-15-7-23-9-17(20(25)27-3)14(15)6-19(11)28-21(26)18-10-24-12(2)16-8-22-5-4-13(16)18/h4-5,8-11,14-15,19,23H,6-7H2,1-3H3
InChIKey: UUUVDTPLNZNLMK-UHFFFAOYSA-N
Reference
Four New Dimeric Monoterpene Alkaloids from Scaevola racemigera Däniker (Goodeniaceae)
PubChem CID: 13857102
LOTUS: LTS0041767
COCONUT: CNP0186891.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Scaevola | Goodeniaceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 381.4320000000001
TPSA？: 90.41
MolLogP？: 2.3959200000000003
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|