| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1375358 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C32H48O8 |
charge | 0 |
mass | 560.728 |
reference | chebi:3942 |
InChIKey | DGIGXLXLGBAJJN-TUOUHCSQSA-N |
InChI | InChI=1S/C32H48O8/c1-18(34)40-27(2,3)14-13-24(37)31(8,39)26-21(35)15-29(6)22-11-9-19-20(10-12-23(36)28(19,4)5)32(22,17-33)25(38)16-30(26,29)7/h9,13-14,20-23,26,33,35-36,39H,10-12,15-17H2,1-8H3/b14-13+/t20-,21-,22+,23+,26+,29+,30-,31+,32+/m1/s1 |
SMILES | [CH3:1][C:18](=[O:34])[O:40][C:27]([CH3:2])([CH3:3])/[CH:14]=[CH:13]/[C:24]([C@@:31]([CH3:8])([C@H:26]1[C@H:21]([OH:35])[CH2:15][C@@:29]2([CH3:6])[C@@H:22]3[CH2:11][CH:9]=[C:19]4[C@@H:20]([CH2:10][CH2:12][C@H:23]([OH:36])[C:28]4([CH3:4])[CH3:5])[C@:32]3([CH2:17][OH:33])[C:25](=[O:38])[CH2:16][C@:30]12[CH3:7])[OH:39])=[O:37] |
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