| Name |
Adociasulfate 2 |
| Formula |
C36H54O9S2 |
| Mw |
694.32092478 |
| CAS RN |
208181-29-7 |
| C_ID |
C00041319
, 
|
| InChIKey |
XXJQNRPPCJSVDF-YHVAKACXNA-N |
| InChICode |
InChI=1S/C36H54O9S2/c1-31(2)15-8-16-36(7)25(31)11-18-34(5)27-12-17-33(4)26(32(27,3)20-14-29(34)43-36)13-19-35(6)28(33)21-22-23(44-46(37,38)39)9-10-24(30(22)35)45-47(40,41)42/h9-10,25-29H,8,11-21H2,1-7H3,(H,37,38,39)(H,40,41,42)/t25-,26+,27+,28-,29-,32+,33+,34-,35-,36-/m0/s1 |
| SMILES |
CC1(C)CCC[C@]2(C)O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC[C@]4(C)c6c(OS(=O)(=O)O)ccc(OS(=O)(=O)O)c6C[C@@H]54)[C@]3(C)CC[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Chalinidae | Haliclona sp. | Ref. |
|
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