Tyrosine; (S)-form, O-(3-Methyl-2-butenyl), N-Ac
AlkaPlorer ID: AK317083
Synonym: N-Acetyl-O-prenyltyrosine
IUPAC Name: 2-acetamido-3-[4-(3-methylbut-2-enoxy)phenyl]propanoic acid
Structure
SMILES: CC(C)=CCOC1=CC=C(CC(N=C(C)O)C(=O)O)C=C1
InChI: InChI=1S/C16H21NO4/c1-11(2)8-9-21-14-6-4-13(5-7-14)10-15(16(19)20)17-12(3)18/h4-8,15H,9-10H2,1-3H3,(H,17,18)(H,19,20)
InChIKey: YHKFAYFIUKFOFG-UHFFFAOYSA-N
Reference
A Novel 5-HT Receptor Ligand and Related Cytotoxic Compounds from an Acid Mine Waste Extremophile
PubChem CID: 10402027
CAS: 592534-82-2
LOTUS: LTS0099248
COCONUT: CNP0110827.1
{NPAtlas: NPA000013
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pithomyces sp. | Pithomyces | Astrosphaeriellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
| None | Pithomyces | Astrosphaeriellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 291.347
TPSA？: 79.12
MolLogP？: 3.0037000000000003
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia | Artemia | Activity | nan | None | 10.1021/np030044w |
| Rattus norvegicus | Serotonin 2a (5-HT2a) receptor | Activity | 85.0 | % | 10.1021/np030044w |