epi-tulipinolide

Properties Image MNX_ID MNXM52274 reference chebi:10552 formula C17H22O4 global charge 0 mol weight 290.359 InChIKey UPNVKIZABMRHNR-PWCAFIOLSA-N InChI InChI=1S/C17H22O4/c1-10-6-5-7-11(2)9-15-16(12(3)17(19)21-15)14(8-10)20-13(4)18/h6,9,14-16H,3,5,7-8H2,1-2,4H3/b10-6+,11-9+/t14-,15-,16-/m1/s1 SMILES C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(\C)C[C@@H](OC(C)=O)[C@@H]12 MNX internals InChI (mnx) InChI=1/C17H22O4/c1-10-6-5-7-11(2)9-15-16(12(3)17(19)21-15)14(8-10)20-13(4)18/h6,9,14-16H,3,5,7-8H2,1-2,4H3/b10-6+,11-9+/t14-,15-,16-/m1/s1 SMILES (mnx) [CH3:1]/[C:10]1=[CH:6]\[CH2:5][CH2:7]/[C:11]([CH3:2])=[CH:9]/[C@@H:15]2[C@H:16]([C:12](=[CH2:3])[C:17](=[O:19])[O:21]2)[C@H:14]([O:20][C:13]([CH3:4])=[O:18])[CH2:8]1

Parent-child relations graph

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