Name |
Ardimerin digallate |
Formula |
C42H40O28 |
Mw |
992.1706107 |
CAS RN |
937791-42-9 |
C_ID |
C00038493
,
|
InChIKey |
ONZYQPWZEUUVIL-KFXKDJTRNA-N |
InChICode |
InChI=1S/C42H40O28/c1-61-35-19(65-41-29(53)27(51)25(49)21(67-41)9-63-37(57)11-3-15(43)23(47)16(44)4-11)7-13-33(31(35)55)69-40(60)14-8-20(36(62-2)32(56)34(14)70-39(13)59)66-42-30(54)28(52)26(50)22(68-42)10-64-38(58)12-5-17(45)24(48)18(46)6-12/h3-8,21-22,25-30,41-56H,9-10H2,1-2H3/t21-,22-,25-,26-,27+,28+,29-,30?,41-,42-/m1/s1 |
SMILES |
c12c(C(=O)Oc3c(C(=O)O1)cc(c(c3O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)c1cc(c(c(c1)O)O)O)O)O)O)cc(c(c2O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)c1cc(c(c(c1)O)O)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Myrsinaceae | Ardisia japonica | Ref. |
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zoom in
Organism | Ardisia japonica | Reference | Dat,J.Nat.Prod.,70,(2007),839 |
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