caseanigrescen A

Properties Image Occurences in reactions MNX_ID MNXM103546 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C30H42O10 charge 0 mass 562.2778 reference chebi:65588 InChIKey GFJLYOYUCCNCHS-XAOZSVRPSA-N InChI InChI=1S/C30H42O10/c1-9-11-24(34)39-21-14-22-27(37-19(6)32)40-28(38-20(7)33)30(22)23(15-21)29(8,13-12-16(3)10-2)17(4)25(26(30)35)36-18(5)31/h10,14,17,21,23,25-28,35H,2-3,9,11-13,15H2,1,4-8H3/t17-,21+,23+,25-,26+,27+,28-,29-,30-/m1/s1 SMILES C=CC(=C)CC[C@]1(C)[C@H](C)[C@@H](OC(C)=O)[C@H](O)[C@@]23C(=C[C@H](OC(=O)CCC)C[C@@H]12)[C@@H](OC(C)=O)O[C@H]3OC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph