| Name |
Pavetannin B 7 |
| Formula |
C45H34O18 |
| Mw |
862.17451429 |
| CAS RN |
164204-63-1 |
| C_ID |
C00009301
, 
|
| InChIKey |
PGKGIQLKUPNZFG-SBTSTCQGNA-N |
| InChICode |
InChI=1S/C45H34O18/c46-18-10-27(54)33-30(11-18)60-44(16-2-5-21(48)25(52)8-16)42(57)37(33)36-32(61-44)14-28(55)34-38-35-31(62-45(43(38)58,63-41(34)36)17-3-6-22(49)26(53)9-17)13-23(50)19-12-29(56)39(59-40(19)35)15-1-4-20(47)24(51)7-15/h1-11,13-14,29,37-39,42-43,46-58H,12H2/t29-,37-,38+,39-,42-,43-,44+,45+/m1/s1 |
| SMILES |
c1c(cc(c2c1O[C@@]1([C@@H]([C@H]2c2c(O1)cc(c1c2O[C@]2([C@@H]([C@@H]1c1c(O2)cc(c2c1O[C@H](c1ccc(c(c1)O)O)[C@@H](C2)O)O)O)c1cc(c(cc1)O)O)O)O)c1ccc(c(c1)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Pavetta owariensis  | Ref. |
|
|
zoom in
|
