Scaevodimerine A
AlkaPlorer ID: AK313014
Synonym: None
IUPAC Name: (4-methoxycarbonyl-7-methyl-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-yl) 1-methyl-1,2-dihydro-2,7-naphthyridine-4-carboxylate
Structure
SMILES: COC(=O)C1=CNCC2C1CC(OC(=O)C1=CNC(C)C3=CN=CC=C13)C2C
InChI: InChI=1S/C21H25N3O4/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/h4-5,8-12,14-15,19,23-24H,6-7H2,1-3H3
InChIKey: OLILADGYLCBVII-UHFFFAOYSA-N
Reference
Four New Dimeric Monoterpene Alkaloids from Scaevola racemigera Däniker (Goodeniaceae)
PubChem CID: 13857100
LOTUS: LTS0252983
COCONUT: CNP0250264.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos spinosa | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Scaevola | Goodeniaceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 383.4480000000001
TPSA？: 89.55
MolLogP？: 1.930799999999999
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|