Militarinone B
AlkaPlorer ID: AK045863
Synonym: None
IUPAC Name: (3E)-5-[hydroxy-(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E,8R,10R)-1-hydroxy-6,8,10-trimethyldodeca-2,4,6-trienylidene]pyrrolidine-2,4-dione
Structure
SMILES: CC[C@@H](C)C[C@@H](C)/C=C(C)/C=C/C=C/C(O)=C1/C(=O)C(C(O)C2=CC=C(O)C=C2)N=C1O
InChI: InChI=1S/C26H33NO5/c1-5-16(2)14-18(4)15-17(3)8-6-7-9-21(29)22-25(31)23(27-26(22)32)24(30)19-10-12-20(28)13-11-19/h6-13,15-16,18,23-24,28-30H,5,14H2,1-4H3,(H,27,32)/b8-6+,9-7+,17-15+,22-21+/t16-,18-,23?,24?/m1/s1
InChIKey: NKHVQSJVSMTQID-YNUTZCEOSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Paecilomyces | Thermoascaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 439.5520000000001
TPSA？: 110.35
MolLogP？: 5.276500000000007
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | PC-12 | Activity | 16.8 | % | 10.1021/np020430y |
| Rattus norvegicus | PC-12 | Activity | nan | None | 10.1021/np020430y |