| Name |
3-O-(E)-Caffeoyl-1,4-di-O-galloyl-beta-D-glucopyranose |
| Formula |
C29H26O17 |
| Mw |
646.11699941 |
| CAS RN |
359819-45-7 |
| C_ID |
C00032652
, 
|
| InChIKey |
XTFLDMSXWVBSOB-IGLHONHCNA-N |
| InChICode |
InChI=1S/C29H26O17/c30-10-20-25(45-27(41)12-6-16(33)22(38)17(34)7-12)26(44-21(37)4-2-11-1-3-14(31)15(32)5-11)24(40)29(43-20)46-28(42)13-8-18(35)23(39)19(36)9-13/h1-9,20,24-26,29-36,38-40H,10H2/b4-2+/t20-,24-,25-,26-,29+/m1/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](O)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)O[C@H](CO)[C@H]1OC(=O)c1cc(O)c(O)c(O)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Balanophoraceae | Balanophora japonica | Ref. |
|
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