9,11-Dideoxy-9alpha,11alpha-methanoepoxy prostaglandin F2alpha

Properties Image MNX_ID MNXM819756 reference sabiorkM:31011 formula C21H34O4 global charge 0 mol weight 350.499 InChIKey LQANGKSBLPMBTJ-BRSNVKEHSA-N InChI InChI=1S/C21H34O4/c1-2-3-6-9-17(22)12-13-19-18(16-14-20(19)25-15-16)10-7-4-5-8-11-21(23)24/h4,7,12-13,16-20,22H,2-3,5-6,8-11,14-15H2,1H3,(H,23,24)/b7-4-,13-12+/t16-,17+,18+,19-,20-/m1/s1 SMILES CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@H]2CO[C@@H]1C2 MNX internals InChI (mnx) InChI=1/C21H34O4/c1-2-3-6-9-17(22)12-13-19-18(16-14-20(19)25-15-16)10-7-4-5-8-11-21(23)24/h4,7,12-13,16-20,22H,2-3,5-6,8-11,14-15H2,1H3,(H,23,24)/b7-4-,13-12+/t16-,17+,18+,19-,20-/m1/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:6][CH2:9][C@@H:17](/[CH:12]=[CH:13]/[C@@H:19]1[C@@H:18]([CH2:10]/[CH:7]=[CH:4]\[CH2:5][CH2:8][CH2:11][C:21](=[O:23])[OH:24])[C@@H:16]2[CH2:14][C@H:20]1[O:25][CH2:15]2)[OH:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0