9,11-Epoxymethano-prostaglandin H2

Properties Image MNX_ID MNXM166714 reference sabiorkM:28717 formula C21H34O4 global charge 0 mol weight 350.499 InChIKey DJKDIKIDYDXHDD-RTYMFESYSA-N InChI InChI=1S/C21H34O4/c1-2-3-6-9-17(22)12-13-18-16-14-20(25-15-16)19(18)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+ SMILES CCCCCC(O)/C=C/C1C2COC(C2)C1C/C=C/CCCC(=O)O MNX internals InChI (mnx) InChI=1/C21H34O4/c1-2-3-6-9-17(22)12-13-18-16-14-20(25-15-16)19(18)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? SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:6][CH2:9][CH:17](/[CH:12]=[CH:13]/[CH:18]1[CH:16]2[CH2:14][CH:20]([CH:19]1[CH2:10]/[CH:7]=[CH:4]/[CH2:5][CH2:8][CH2:11][C:21](=[O:23])[OH:24])[O:25][CH2:15]2)[OH:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0