compound 0209308

Properties Image MNX_ID MNXM1305022 reference envipathM:...53d0b755816d formula C26H43O8 global charge -1 mol weight 483.622 InChIKey OQKVEHMMIJPFFZ-UHFFFAOYSA-M InChI InChI=1S/C26H44O8/c1-14(4-5-20(30)31)16-7-10-25(33)21-18(12-19(29)24(16,25)3)23(2)9-6-15(28)13-26(23,34)17(8-11-27)22(21)32/h14-19,21-22,27-29,32-34H,4-13H2,1-3H3,(H,30,31)/p-1 SMILES CC(CCC(=O)[O-])C1CCC2(O)C3C(O)C(CCO)C4(O)CC(O)CCC4(C)C3CC(O)C12C MNX internals InChI (mnx) InChI=1/C26H44O8/c1-14(4-5-20(30)31)16-7-10-25(33)21-18(12-19(29)24(16,25)3)23(2)9-6-15(28)13-26(23,34)17(8-11-27)22(21)32/h14-19,21-22,27-29,32-34H,4-13H2,1-3H3,(H,30,31)/t14?,15?,16?,17?,18?,19?,21?,22?,23?,24?,25?,26? SMILES (mnx) [CH3:1][CH:14]([CH2:4][CH2:5][C:20](=[O:30])[OH:31])[CH:16]1[CH2:7][CH2:10][C:25]2([OH:33])[CH:21]3[CH:18]([CH2:12][CH:19]([OH:29])[C:24]12[CH3:3])[C:23]1([CH3:2])[CH2:9][CH2:6][CH:15]([OH:28])[CH2:13][C:26]1([OH:34])[CH:17]([CH2:8][CH2:11][OH:27])[CH:22]3[OH:32]

Parent-child relations graph

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