| Properties | Image | Occurences in reactions |
MNX_ID | MNXM21430 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
|
formula | C27H29O17 |
charge | -1 |
mass | 625.512 |
reference | seedM:cpd25005 |
InChIKey | YOXWSUCVDVXAMX-LOZUMUMPSA-M |
InChI | InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)41-13-5-9(30)4-12-16(13)19(35)25(24(40-12)8-1-2-10(31)11(32)3-8)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/p-1/t14-,15-,17?,18-,20+,21+,22?,23-,26?,27?/m1/s1 |
SMILES | [cH:1]1[cH:2][c:10]([OH:31])[c:11]([OH:32])[cH:3][c:8]1-[c:24]1[c:25]([O:44][CH:27]2[C@H:23]([OH:39])[C@@H:21]([OH:37])[C@H:18]([OH:34])[C@@H:15]([CH2:7][OH:29])[O:43]2)[c:19](=[O:35])[c:16]2[c:12]([cH:4][c:9]([OH:30])[cH:5][c:13]2[O:41][CH:26]2[CH:22]([OH:38])[C@@H:20]([OH:36])[CH:17]([OH:33])[C@@H:14]([CH2:6][OH:28])[O:42]2)[o:40]1 |
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