Name |
Acacetin 7-rhamnosyl-(1->4'')[glucosyl-(1->6'')(6'''-acetylsophoroside)] |
Formula |
C42H54O25 |
Mw |
958.29541728 |
CAS RN |
109517-74-0 |
C_ID |
C00004213
,
|
InChIKey |
QOZYYIZALVCMCA-GBQGJZGPNA-N |
InChICode |
InChI=1S/C42H54O25/c1-14-27(47)30(50)34(54)40(60-14)66-37-25(13-59-39-33(53)31(51)28(48)23(11-43)63-39)65-42(38(36(37)56)67-41-35(55)32(52)29(49)24(64-41)12-58-15(2)44)61-18-8-19(45)26-20(46)10-21(62-22(26)9-18)16-4-6-17(57-3)7-5-16/h4-10,14,23-25,27-43,45,47-56H,11-13H2,1-3H3/t14-,23+,24+,25+,27-,28-,29-,30-,31-,32-,33+,34+,35-,36-,37-,38?,39+,40-,41-,42+/m0/s1 |
SMILES |
c1(cc(c2c(c1)oc(cc2=O)c1ccc(cc1)OC)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O[C@H]1[C@H]([C@H]([C@H]([C@H](O1)COC(=O)C)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Nitrariaceae | Peganum harmala | Ref. |
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Organism | Peganum harmala | Reference | Harborne, The Handbook of Natural Flavonoids, 1, (1999), 3.Flavone O-glycosides, John Wiley & Son
Ahmed,J.Nat.Prod.,50,(1987),256 |
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