Name |
Insularoside 3'-O-beta-D-glucoside |
Formula |
C38H46O18 |
Mw |
790.26841467 |
CAS RN |
204522-47-4 |
C_ID |
C00042613
,
|
InChIKey |
HSKJIGQLAWRQNO-JLPAEHNYNA-N |
InChICode |
InChI=1S/C38H46O18/c1-2-21-22-14-28(42)49-11-10-19-5-8-24(41)25(13-19)52-20-6-3-18(4-7-20)9-12-50-35(48)23(22)17-51-36(21)56-38-33(47)34(30(44)27(16-40)54-38)55-37-32(46)31(45)29(43)26(15-39)53-37/h2-8,13,17,22,26-27,29-34,36-41,43-47H,9-12,14-16H2,1H3/b21-2+/t22-,26+,27+,29+,30+,31-,32+,33+,34-,36-,37-,38-/m0/s1 |
SMILES |
C12=CO[C@H](/C(=C/C)/[C@@H]1CC(=O)OCCc1cc(c(cc1)O)Oc1ccc(CCOC2=O)cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Oleaceae | Fraxinus insularis | Ref. |
|
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