| Name |
Eranthisaponin B
(-)-Eranthisaponin B |
| Formula |
C83H136O45 |
| Mw |
1852.83536234 |
| CAS RN |
562814-99-7 |
| C_ID |
C00044751
, 
|
| InChIKey |
FJSGLUCJQAAALA-LSALPKGDNA-N |
| InChICode |
InChI=1S/C83H136O45/c1-28-42(88)48(94)56(102)70(114-28)125-65-34(22-85)118-68(61(107)54(65)100)111-24-36-45(91)51(97)59(105)74(120-36)124-64-30(3)116-72(63(109)53(64)99)126-66-35(23-86)119-69(62(108)55(66)101)112-25-37-46(92)52(98)60(106)75(121-37)128-77(110)83-18-16-78(4,5)20-32(83)31-10-11-40-79(6)14-13-41(80(7,27-87)39(79)12-15-82(40,9)81(31,8)17-19-83)123-76-67(127-71-57(103)49(95)43(89)29(2)115-71)47(93)38(26-113-76)122-73-58(104)50(96)44(90)33(21-84)117-73/h10,28-30,32-76,84-109H,11-27H2,1-9H3/t28-,29-,30-,32-,33+,34+,35+,36+,37+,38-,39-,40+,41+,42-,43-,44+,45+,46+,47-,48+,49+,50-,51-,52-,53-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64-,65+,66+,67+,68+,69+,70-,71-,72-,73-,74-,75-,76-,79-,80-,81+,82+,83-/m0/s1 |
| SMILES |
[C@@H]1([C@@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]1[C@H](O)[C@H]([C@@H](OC1)O[C@@H]1CC[C@]2([C@@H]([C@]1(C)CO)CC[C@@]1([C@@H]2CC=C2[C@]1(CC[C@@]1([C@H]2CC(CC1)(C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O[C@H]1[C@H](O)[C@@H]([C@H]([C@@H](O1)C)O)O)CO)C)O)O)C)C)C)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)CO)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Eranthis cilicica | Ref. |
|
|
zoom in
|
