| Name |
Hederacoside A |
| Formula |
C41H66O13 |
| Mw |
766.4503422 |
| CAS RN |
26339-89-9 |
| C_ID |
C00046764
, 
|
| InChIKey |
YNMWBVNUVVDDPQ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)54-34-31(47)29(45)24(53-34)19-51-33-32(48)30(46)28(44)23(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32+,33+,34-,37-,38+,39-,40+,41+/m1/s1 |
| SMILES |
C1(CC[C@]2([C@H](C1)C1=CC[C@H]3[C@@]([C@@]1(CC2)C)(CC[C@@H]1[C@]3(CC[C@H]([C@]1(CO)C)O[C@@H]1[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)O)C)C)C(=O)O)(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Berberidaceae | Bongardia chrysogonum  | Ref. |
|
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