Melophlins; Melophlin M
AlkaPlorer ID: AK305502
Synonym: 3-(1-Hydroxydodecylidene)-1,5-dimethyl-2,4-pyrrolidinedione
IUPAC Name: 4-dodecanoyl-3-hydroxy-1,2-dimethyl-2H-pyrrol-5-one
Structure
SMILES: CCCCCCCCCCC/C(O)=C1\C(=O)C(C)N(C)C1=O
InChI: InChI=1S/C18H31NO3/c1-4-5-6-7-8-9-10-11-12-13-15(20)16-17(21)14(2)19(3)18(16)22/h14,20H,4-13H2,1-3H3/b16-15-
InChIKey: CELZEZYUAVUZRU-NXVVXOECSA-N
Reference
CAS: 499136-76-4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Melophlus | Ancorinidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 309.45000000000005
TPSA？: 57.61
MolLogP？: 4.149000000000003
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HeLa | Activity | None | None | 10.1021/np0202778 |
| Homo sapiens | TF-1 | Activity | None | None | 10.1021/np0202778 |