1.0 2016-09-30 22:48:12 UTC 2020-04-22 15:08:52 UTC BMDB0001855 BMDB01855 5-Hydroxytryptophol 5-HTOL 5-Hydroxy-1H-indole-3-ethanol 5-Hydroxy-1H-indole-3-ethanol(9ci) 5-Hydroxy-3-indole 5-Hydroxy-3-indoleacetic acid 5-Hydroxy-indole-acetic acid 5-Hydroxyindoacetic acid 5-Hydroxyindol 5-Hydroxyindolacetate 5-Hydroxyindolacetic acid 5-Hydroxyindole-3-ethanol 5-Hydroxyindole-acetic acid Hydroxyindoleacetic acid Hydroxytryptophol C10H11NO2 177.1998 177.078978601 3-(2-hydroxyethyl)-1H-indol-5-ol hydroxytryptophol 154-02-9 OCCC1=CNC2=CC=C(O)C=C12 InChI=1S/C10H11NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,5-6,11-13H,3-4H2 KQROHCSYOGBQGJ-UHFFFAOYSA-N belongs to the class of organic compounds known as hydroxyindoles. These are organic compounds containing an indole moiety that carries a hydroxyl group. Organic compounds Organoheterocyclic compounds Indoles and derivatives Hydroxyindoles Hydroxyindoles 1-hydroxy-2-unsubstituted benzenoids 3-alkylindoles Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Primary alcohols Substituted pyrroles 1-hydroxy-2-unsubstituted benzenoid 3-alkylindole Alcohol Aromatic heteropolycyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Hydroxyindole Indole Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary alcohol Pyrrole Substituted pyrrole Aromatic heteropolycyclic compounds a small molecule Solid logp 0.91 ALOGPS logs -1.91 ALOGPS logp 1.29 ChemAxon pka_strongest_acidic 9.56 ChemAxon pka_strongest_basic -2.4 ChemAxon iupac 3-(2-hydroxyethyl)-1H-indol-5-ol ChemAxon average_mass 177.1998 ChemAxon mono_mass 177.078978601 ChemAxon smiles OCCC1=CNC2=CC=C(O)C=C12 ChemAxon formula C10H11NO2 ChemAxon inchi InChI=1S/C10H11NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,5-6,11-13H,3-4H2 ChemAxon inchikey KQROHCSYOGBQGJ-UHFFFAOYSA-N ChemAxon polar_surface_area 56.25 ChemAxon refractivity 50.7 ChemAxon polarizability 18.86 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 22044 Specdb::CMs 38147 Specdb::CMs 157407 Specdb::MsIr 1369 Specdb::MsIr 1370 Specdb::MsIr 1371 Specdb::NmrTwoD 1697 Specdb::MsMs 1720 Specdb::MsMs 1721 Specdb::MsMs 1722 Specdb::MsMs 21302 Specdb::MsMs 21303 Specdb::MsMs 21304 Specdb::MsMs 22853 Specdb::MsMs 22854 Specdb::MsMs 22855 Specdb::MsMs 2814218 Specdb::MsMs 2814219 Specdb::MsMs 2814220 Specdb::MsMs 2890867 Specdb::MsMs 2890868 Specdb::MsMs 2890869 Specdb::NmrOneD 1757 Specdb::NmrOneD 102578 Specdb::NmrOneD 102579 Specdb::NmrOneD 102580 Specdb::NmrOneD 102581 Specdb::NmrOneD 102582 Specdb::NmrOneD 102583 Specdb::NmrOneD 102584 Specdb::NmrOneD 102585 Specdb::NmrOneD 102586 Specdb::NmrOneD 102587 Specdb::NmrOneD 102588 Specdb::NmrOneD 102589 Specdb::NmrOneD 102590 Specdb::NmrOneD 102591 Specdb::NmrOneD 102592 Specdb::NmrOneD 102593 Specdb::NmrOneD 102594 Specdb::NmrOneD 102595 Specdb::NmrOneD 102596 Specdb::NmrOneD 102597 FDB022711 8708 9061 C00045185 5730 Da Prada, M.; Bartholini, G.; Pletscher, A. Formation of 5-hydroxytryptophol by blood platelets after thrombin and reserpine. Experientia (1965), 21(3), 135-6.