Salfredin 8
AlkaPlorer ID: AK132886
Synonym: None
IUPAC Name: (2R)-2-[4-hydroxy-7-oxo-6-(2-phenylethyl)-3,5-dihydro-2H-furo[2,3-f]isoindol-2-yl]propanoic acid
Structure
SMILES: C[C@@H](C(=O)O)C1CC2=C(C=C3C(=O)N(CCC4=CC=CC=C4)CC3=C2O)O1
InChI: InChI=1S/C21H21NO5/c1-12(21(25)26)17-10-15-18(27-17)9-14-16(19(15)23)11-22(20(14)24)8-7-13-5-3-2-4-6-13/h2-6,9,12,17,23H,7-8,10-11H2,1H3,(H,25,26)/t12-,17?/m1/s1
InChIKey: DRHXVHUEEOCNMZ-MTATWXBHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Crucibulum laeve | Crucibulum | Nidulariaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 367.40100000000007
TPSA？: 87.07000000000001
MolLogP？: 2.614900000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|