| Properties | Image | Occurences in reactions |
MNX_ID | MNXM114690 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C30H26O13 |
charge | 0 |
mass | 594.13734 |
reference | metacycM:CPD-14988 |
InChIKey | VNHVNFCIDMAHID-CSUGHPSWSA-N |
InChI | InChI=1S/C30H26O13/c31-13-21-24(37)28(42-22(36)10-3-14-1-6-16(32)7-2-14)26(39)30(41-21)43-29-25(38)23-19(35)11-18(34)12-20(23)40-27(29)15-4-8-17(33)9-5-15/h1-12,21,24,26,28,30-35,37,39H,13H2/b10-3+/t21-,24-,26-,28+,30+/m1/s1 |
SMILES | O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@H]1O |
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