Arogenic acid
AlkaPlorer ID: AK289302
Synonym: α-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid, Pretyrosine
IUPAC Name: 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid
Structure
SMILES: NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O
InChI: InChI=1S/C10H13NO5/c11-7(8(13)14)5-10(9(15)16)3-1-6(12)2-4-10/h1-4,6-7,12H,5,11H2,(H,13,14)(H,15,16)
InChIKey: MIEILDYWGANZNH-UHFFFAOYSA-N
Reference
Pico‐tag analysis of arogenic acid and related free amino acids from plant and fungal extracts
PubChem CID: 193887
CAS: 53078-86-7
LOTUS: LTS0034339
COCONUT: CNP0212416.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neurospora crassa | Neurospora | Sordariaceae | Sordariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| None | Pseudomonas | Pseudomonadaceae | Pseudomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 227.216
TPSA？: 120.85
MolLogP？: -0.6537000000000002
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|