| Properties | Image | Occurences in reactions |
MNX_ID | MNXM108431 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C21H30O7 |
charge | 0 |
mass | 394.19915 |
reference | chebi:67680 |
InChIKey | UHERRNNNKBWWKU-JVWDHMGKSA-N |
InChI | InChI=1S/C21H30O7/c1-9-10-5-6-11-19-12(22)7-8-18(2,3)13(19)16(25)21(26,28-17(19)27-4)20(11,14(9)23)15(10)24/h10-13,15-17,22,24-26H,1,5-8H2,2-4H3/t10-,11+,12+,13-,15-,16+,17-,19+,20+,21-/m1/s1 |
SMILES | C=C1C(=O)[C@@]23[C@@H](CC[C@H]1[C@H]2O)[C@]12[C@@H](O)CCC(C)(C)[C@H]1[C@H](O)[C@@]3(O)O[C@H]2OC |
|