18,19-Epoxy macrolactin A

Properties Image MNX_ID MNXM101497 reference chebi:69183 formula C24H34O6 global charge 0 mol weight 418.53 InChIKey CZLKSWQTORVBNM-VFDZIYPSSA-N InChI InChI=1S/C24H34O6/c1-18-9-8-13-22-23(30-22)16-15-21(27)17-20(26)12-6-2-4-10-19(25)11-5-3-7-14-24(28)29-18/h2-7,10,14-16,18-23,25-27H,8-9,11-13,17H2,1H3/b5-3+,6-2-,10-4+,14-7-,16-15+/t18-,19-,20+,21+,22+,23+/m1/s1 SMILES C[C@@H]1CCC[C@@H]2O[C@H]2/C=C/[C@H](O)C[C@@H](O)C/C=C\C=C\[C@@H](O)C/C=C/C=C\C(=O)O1 MNX internals InChI (mnx) InChI=1/C24H34O6/c1-18-9-8-13-22-23(30-22)16-15-21(27)17-20(26)12-6-2-4-10-19(25)11-5-3-7-14-24(28)29-18/h2-7,10,14-16,18-23,25-27H,8-9,11-13,17H2,1H3/b5-3+,6-2-,10-4+,14-7-,16-15+/t18-,19-,20+,21+,22+,23+/m1/s1 SMILES (mnx) [CH3:1][C@@H:18]1[CH2:9][CH2:8][CH2:13][C@H:22]2[C@H:23](/[CH:16]=[CH:15]/[C@H:21]([OH:27])[CH2:17][C@@H:20]([OH:26])[CH2:12]/[CH:6]=[CH:2]\[CH:4]=[CH:10]\[C@@H:19]([OH:25])[CH2:11]/[CH:5]=[CH:3]/[CH:7]=[CH:14]\[C:24](=[O:28])[O:29]1)[O:30]2

Parent-child relations graph

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