PDB CCD ID: | OTS |
Number of entries in BioLiP: | 11 |
Chemical formula: | C8 H11 N O2 |
InChI: | InChI=1S/C8H11NO2/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,10-11H,5,9H2/t8-/m1/s1 |
InChIKey: | QHGUCRYDKWKLMG-MRVPVSSYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | NC[CH](O)c1ccc(O)cc1 | OpenEye OEToolkits 1.5.0 | c1cc(ccc1C(CN)O)O | CACTVS 3.341 | NC[C@@H](O)c1ccc(O)cc1 | OpenEye OEToolkits 1.5.0 | c1cc(ccc1[C@@H](CN)O)O | ACDLabs 10.04 | OC(c1ccc(O)cc1)CN |
|
Name: | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL; S-OCTOPAMINE |
ChEMBL: | CHEMBL1235033 |
ZINC: | ZINC000000000558 |