| Name |
Synallactoside B1
(-)-Synallactoside B1 |
| Formula |
C67H106O31 |
| Mw |
1406.67180667 |
| CAS RN |
478699-47-7 |
| C_ID |
C00046446
, 
|
| InChIKey |
AFUKQDJQKKVYHP-FIRNYYRHNA-N |
| InChICode |
InChI=1S/C67H106O31/c1-27(2)20-30(89-29(4)70)21-66(9)39-15-18-65(8)32-12-13-38-63(5,6)40(16-17-64(38,7)31(32)14-19-67(39,65)62(82)98-66)93-61-55(43(75)37(26-87-61)92-59-49(81)54(42(74)36(23-69)90-59)96-56-46(78)51(83-10)33(71)24-85-56)97-58-45(77)44(76)50(28(3)88-58)94-57-47(79)52(34(72)25-86-57)95-60-48(80)53(84-11)41(73)35(22-68)91-60/h12,28,30-31,33-61,68-69,71-81H,1,13-26H2,2-11H3/t28-,30+,31-,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+,64-,65+,66+,67-/m1/s1 |
| SMILES |
C=C(C)C[C@@H](C[C@]1(C)OC(=O)[C@]23CC[C@@H]4C(=CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](OC)[C@H]8O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@H](C)[C@@H](O[C@@H]7OC[C@@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](OC)[C@H]8O)[C@H]7O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]2(C)CC[C@@H]31)OC(C)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Synallactes nozawai | Ref. |
|
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