| Properties | Image | Occurences in reactions |
MNX_ID | MNXM102850 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C44H50O13 |
charge | 0 |
mass | 786.32514 |
reference | chebi:65447 |
InChIKey | XHGXNCJQYFUJOZ-UHFFFAOYSA-N |
InChI | InChI=1S/C44H50O13/c1-20(2)14-30(47)25-10-12-29(46)36(41(25)53-8)39(51)35-27(16-22(5)18-31(35)48)43-38(50)28-17-23(6)19-32(49)40(28)56-33-13-11-26(34(15-21(3)4)55-24(7)45)42(54-9)37(33)44(52)57-43/h10-13,16-21,30,34,38,43,46-50H,14-15H2,1-9H3 |
SMILES | COc1c(C(O)CC(C)C)ccc(O)c1C(=O)c1c(O)cc(C)cc1C1OC(=O)c2c(ccc(C(CC(C)C)OC(C)=O)c2OC)Oc2c(O)cc(C)cc2C1O |
|