Salfredin C1; N-(1-Carboxyethyl)
AlkaPlorer ID: AK312824
Synonym: Salfredin C3
IUPAC Name: 2-[6-(1-carboxyethyl)-4-hydroxy-5,7-dioxo-2,3-dihydrofuro[3,2-f]isoindol-2-yl]propanoic acid
Structure
SMILES: CC(C(=O)O)C1CC2=C(O)C3=C(C=C2O1)C(=O)N(C(C)C(=O)O)C3=O
InChI: InChI=1S/C16H15NO8/c1-5(15(21)22)9-3-7-10(25-9)4-8-11(12(7)18)14(20)17(13(8)19)6(2)16(23)24/h4-6,9,18H,3H2,1-2H3,(H,21,22)(H,23,24)
InChIKey: VQOAQUIDELNUAB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Crucibulum | Calyptraeidae | Littorinimorpha | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 349.2950000000001
TPSA？: 141.44000000000003
MolLogP？: 0.4855
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|