| Properties | Image | Occurences in reactions |
MNX_ID | MNXM101478 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C31H52O7 |
charge | 0 |
mass | 536.3713 |
reference | chebi:70462 |
InChIKey | DRHYLVNJSZLPMV-IOXGOOADSA-N |
InChI | InChI=1S/C31H52O7/c1-26(2,35)20-11-15-30(7)21(28(20,5)14-13-23(32)33)10-9-19-24-31(25(34)37-8,18-17-29(19,30)6)16-12-22(38-24)27(3,4)36/h19-22,24,35-36H,9-18H2,1-8H3,(H,32,33)/t19-,20+,21-,22+,24-,28+,29-,30-,31+/m1/s1 |
SMILES | COC(=O)[C@]12CC[C@@H](C(C)(C)O)O[C@@H]1[C@H]1CC[C@@H]3[C@@](C)(CCC(=O)O)[C@H](C(C)(C)O)CC[C@@]3(C)[C@]1(C)CC2 |
|