16-estratetraen-3-ol

Properties Image MNX_ID MNXM33517 reference chebi:62849 formula C18H22O global charge 0 mol weight 254.373 InChIKey CRMOMCHYBNOFIV-BDXSIMOUSA-N InChI InChI=1S/C18H22O/c1-18-9-2-3-17(18)16-6-4-12-11-13(19)5-7-14(12)15(16)8-10-18/h2,5,7,9,11,15-17,19H,3-4,6,8,10H2,1H3/t15-,16-,17+,18+/m1/s1 SMILES C[C@@]12C=CC[C@H]1[C@@H]1CCC3=CC(O)=CC=C3[C@H]1CC2 MNX internals InChI (mnx) InChI=1/C18H22O/c1-18-9-2-3-17(18)16-6-4-12-11-13(19)5-7-14(12)15(16)8-10-18/h2,5,7,9,11,15-17,19H,3-4,6,8,10H2,1H3/t15-,16-,17+,18+/m1/s1 SMILES (mnx) [CH3:1][C@@:18]12[CH:9]=[CH:2][CH2:3][C@H:17]1[C@@H:16]1[CH2:6][CH2:4][C:12]3=[CH:11][C:13]([OH:19])=[CH:5][CH:7]=[C:14]3[C@H:15]1[CH2:8][CH2:10]2

Parent-child relations graph

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