| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1379255 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C21H20O12 |
charge | 0 |
mass | 464.379 |
reference | chebi:66907 |
InChIKey | SFXSFWVZPKEDPA-LNCSSOGTSA-N |
InChI | InChI=1S/C21H20O12/c22-6-14-18(28)19(29)20(30)21(33-14)31-8-4-9(23)15-12(5-8)32-13(17(15)27)3-7-1-10(24)16(26)11(25)2-7/h1-5,14,18-26,28-30H,6H2/t14-,18-,19+,20-,21-/m1/s1 |
SMILES | [cH:1]1[c:7]([CH:3]=[C:13]2[C:17](=[O:27])[c:15]3[c:9]([OH:23])[cH:4][c:8]([O:31][C@H:21]4[C@H:20]([OH:30])[C@@H:19]([OH:29])[C@H:18]([OH:28])[C@@H:14]([CH2:6][OH:22])[O:33]4)[cH:5][c:12]3[O:32]2)[cH:2][c:11]([OH:25])[c:16]([OH:26])[c:10]1[OH:24] |
|