5-Androstenetriol

Properties Image MNX_ID MNXM38036 reference chebi:89531 formula C19H30O3 global charge 0 mol weight 306.446 InChIKey GUGSXATYPSGVAY-DHKQUUGRSA-N InChI InChI=1S/C19H30O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-17,20-22H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,17-,18-,19-/m0/s1 SMILES C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1C[C@@H](O)[C@@H]2O MNX internals InChI (mnx) InChI=1/C19H30O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-17,20-22H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,17-,18-,19-/m0/s1 SMILES (mnx) [CH3:1][C@:18]12[CH2:7][CH2:5][C@H:12]([OH:20])[CH2:9][C:11]1=[CH:3][CH2:4][C@@H:13]1[C@@H:14]2[CH2:6][CH2:8][C@@:19]2([CH3:2])[C@H:15]1[CH2:10][C@@H:16]([OH:21])[C@@H:17]2[OH:22]

Parent-child relations graph

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