Palythine-threonine; 7-O-Sulfate
AlkaPlorer ID: AK309263
Synonym: Palythine-threonine sulfate
IUPAC Name: 2-[[3-amino-5-hydroxy-2-methoxy-5-(sulfooxymethyl)cyclohex-2-en-1-ylidene]amino]-3-hydroxybutanoic acid
Structure
SMILES: COC1=C(NC(C(=O)O)C(C)O)CC(O)(COS(=O)(=O)O)CC1=N
InChI: InChI=1S/C12H20N2O9S/c1-6(15)9(11(16)17)14-8-4-12(18,5-23-24(19,20)21)3-7(13)10(8)22-2/h6,9,13-15,18H,3-5H2,1-2H3,(H,16,17)(H,19,20,21)
InChIKey: XMVQIMCWANUSQQ-UHFFFAOYSA-N
Reference
COCONUT: CNP0018194.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stylophora pistillata | Stylophora | Pocilloporidae | Scleractinia | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 368.364
TPSA？: 186.47
MolLogP？: -1.367929999999998
Number of H-Donors: 6
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|