| Name |
Saniculoside N
(-)-Saniculoside N |
| Formula |
C55H88O22 |
| Mw |
1100.5767245 |
| CAS RN |
196955-52-9 |
| C_ID |
C00050403
, 
|
| InChIKey |
VARHIPCGZLKSDN-ZGHXDOEWNA-N |
| InChICode |
InChI=1S/C55H88O22/c1-11-19-70-46(69)40-36(63)39(75-48-35(62)33(60)38(28(21-56)72-48)74-47-34(61)32(59)27(58)22-71-47)37(64)49(76-40)73-31-16-17-52(8)29(51(31,6)7)15-18-53(9)30(52)14-13-25-26-20-50(4,5)44(77-45(68)24(3)12-2)43(67)55(26,23-57)42(66)41(65)54(25,53)10/h12-13,26-44,47-49,56-67H,11,14-23H2,1-10H3/b24-12-/t26-,27+,28+,29-,30+,31-,32+,33+,34-,35+,36+,37+,38+,39-,40-,41-,42+,43-,44-,47-,48-,49+,52-,53+,54-,55-/m0/s1 |
| SMILES |
C1[C@]2([C@H](C([C@H](C1)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@H]([C@@H]([C@@H](CO1)O)O)O)O)O)O)C(=O)OCCC)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1([C@H]([C@H]([C@@]1([C@H]2CC([C@H]([C@@H]1O)OC(=O)/C(=C\C)/C)(C)C)CO)O)O)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apiaceae | Sanicula europaea  | Ref. |
|
|
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