klymollin H

Properties Image Occurences in reactions MNX_ID MNXM105976 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C27H40O11 charge 0 mass 540.25706 reference chebi:68958 InChIKey PJSHPOHLUBKHTG-ADWFZQLOSA-N InChI InChI=1S/C27H40O11/c1-13(2)19-20-21(27(11-34-27)24(36-15(4)30)22(19)35-14(3)29)17-10-25(6,32)18(33-12-28)8-9-26(7,23(20)37-17)38-16(5)31/h12-13,17-24,32H,8-11H2,1-7H3/t17-,18+,19-,20-,21-,22+,23-,24+,25+,26-,27-/m1/s1 SMILES CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@]2(CO2)[C@@H]2[C@H]3C[C@](C)(O)[C@@H](OC=O)CC[C@@](C)(OC(C)=O)[C@H](O3)[C@@H]2[C@H]1C(C)C

Parent-child relations graph

Deprecated MNXref IDs graph