| Properties | Image | Occurences in reactions |
MNX_ID | MNXM129911 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
|
formula | C23H35O7 |
charge | -1 |
mass | 423.23883 |
reference | metacycM:CPD-16945 |
InChIKey | TUZYXOIXSAXUGO-PZSHMICQSA-M |
InChI | InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/p-1/t13-,14-,16+,17-,18+,19-,20-,22-/m0/s1 |
SMILES | CC[C@H](C)C(=O)O[C@H]1C[C@@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)[O-])[C@H]21 |
|