Ieodomycin A

Properties Image MNX_ID MNXM105692 reference chebi:69905 formula C13H22O4 global charge 0 mol weight 242.315 InChIKey LMFWMDRALYGQES-SRXIBPRUSA-N InChI InChI=1S/C13H22O4/c1-4-5-10(2)6-7-11(14)8-12(15)9-13(16)17-3/h4-5,11-12,14-15H,1,6-9H2,2-3H3/b10-5+/t11-,12+/m1/s1 SMILES C=C/C=C(\C)CC[C@@H](O)C[C@H](O)CC(=O)OC MNX internals InChI (mnx) InChI=1/C13H22O4/c1-4-5-10(2)6-7-11(14)8-12(15)9-13(16)17-3/h4-5,11-12,14-15H,1,6-9H2,2-3H3/b10-5+/t11-,12+/m1/s1 SMILES (mnx) [CH2:1]=[CH:4]/[CH:5]=[C:10](\[CH3:2])[CH2:6][CH2:7][C@H:11]([CH2:8][C@@H:12]([CH2:9][C:13](=[O:16])[O:17][CH3:3])[OH:15])[OH:14]

Parent-child relations graph

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