| Name |
Okhotoside B1
(-)-Okhotoside B1 |
| Formula |
C56H88O27S |
| Mw |
1224.52336834 |
| CAS RN |
1016275-25-4 |
| C_ID |
C00039898
, 
|
| InChIKey |
XPXUVHBVDYEUGB-QAKSDDCMNA-N |
| InChICode |
InChI=1S/C56H88O27S/c1-24(2)11-10-16-55(8)46-28(74-25(3)60)19-54(7)27-12-13-33-52(4,5)34(15-17-53(33,6)26(27)14-18-56(46,54)51(68)82-55)78-50-45(37(63)32(23-73-50)83-84(69,70)71)81-47-39(65)38(64)42(31(22-59)77-47)79-49-41(67)44(36(62)30(21-58)76-49)80-48-40(66)43(72-9)35(61)29(20-57)75-48/h12,26,28-50,57-59,61-67H,1,10-11,13-23H2,2-9H3,(H,69,70,71)/t26-,28-,29+,30+,31+,32+,33-,34-,35+,36+,37+,38+,39+,40+,41+,42-,43-,44-,45-,46+,47-,48-,49-,50+,53+,54-,55-,56+/m0/s1 |
| SMILES |
C=C(C)CCC[C@]1(C)OC(=O)[C@]23CC[C@H]4C(=CC[C@H]5C(C)(C)[C@@H](OC6OC[C@@H](OS(=O)(=O)O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[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)C[C@H](OC(C)=O)[C@@H]31 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Cucumariidae | Cucumaria okhotensis | Ref. |
|
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