6alpha-Hydroxycortisol

Properties Image MNX_ID MNXM38982 reference chebi:79793 formula C21H30O6 global charge 0 mol weight 378.465 InChIKey GNFTWPCIRXSCQF-HVIRSNARSA-N InChI InChI=1S/C21H30O6/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,22,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15-,16-,18+,19-,20-,21-/m0/s1 SMILES C[C@]12CCC(=O)C=C1[C@@H](O)C[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO MNX internals InChI (mnx) InChI=1/C21H30O6/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,22,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15-,16-,18+,19-,20-,21-/m0/s1 SMILES (mnx) [CH3:1][C@:19]12[CH2:5][CH2:3][C:11](=[O:23])[CH:7]=[C:14]1[C@@H:15]([OH:24])[CH2:8][C@H:12]1[C@@H:13]3[CH2:4][CH2:6][C@@:21]([C:17]([CH2:10][OH:22])=[O:26])([OH:27])[C@@:20]3([CH3:2])[CH2:9][C@H:16]([OH:25])[C@@H:18]12

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0